0 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,0,0,0,0,0|1,0,1]=2 4 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,0,0,0,0,0|1,0,1]=2 6 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,0,0,0,0,0|4,0,0]=4 7 B6R0.1 C=C=CC(=O)OC MCULE-7885631451 [0,0,0,0,0,0|1,0,2]=3 8 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,0,0,0,0,0|1,1,1]=3 10 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,0,0,0,0,0|3,0,1]=4 11 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,0,0,0,0,0|3,0,1]=4 14 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,0,0,0,0,0|2,0,1]=3 15 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,0,0,0,0,0|1,0,1]=2 16 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,0,0,0,0,0|3,0,1]=4 17 B6R0.1 CC#CC(=O)NN MCULE-2475728417 [0,0,0,0,0,0|3,0,1]=4 18 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,0,0,0,0,0|1,0,1]=2 19 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,0,0,0,0,0|2,0,1]=3 20 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,0,0,0,0,0|1,0,1]=2 21 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,0,0,0,0,0|3,0,0]=3 22 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,0,0,0,0,0|2,0,0]=2 23 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,0,0,0,0,0|2,0,0]=2 24 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,0,0,0,0,0|1,1,0]=2 25 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,0,0,0,0,0|1,0,0]=1 26 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,0,0,0,0,0|2,1,0]=3 27 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.1 CCC(Br)COC MCULE-7942540965 [0,0,0,0,0,0|2,1,1]=4 29 B6R0.1 CCC(C)CNC MCULE-1998406301 [0,0,0,0,0,0|3,0,1]=4 30 B6R0.1 CCC(C)CNC MCULE-5957910094 [0,0,0,0,0,0|3,0,1]=4 31 B6R0.1 CCC(N)COC MCULE-2103613859 [0,0,0,0,0,0|2,1,1]=4 32 B6R0.1 CCC(N)COC MCULE-5835446359 [0,0,0,0,0,0|2,1,1]=4 33 B6R0.1 CCC(N)CSC MCULE-9145513729 [0,0,0,0,0,0|2,0,1]=3 34 B6R0.1 CCC(O)CNC MCULE-2490431367 [0,0,0,0,0,0|2,0,2]=4 35 B6R0.1 CCC(O)COC MCULE-6751000060 [0,0,0,0,0,0|1,1,2]=4 36 B6R0.1 CCC(O)CSC MCULE-3582683720 [0,0,0,0,0,0|1,0,2]=3 37 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,0,0,0,0,0|4,0,0]=4 38 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,0,0,0,0,0|4,0,0]=4 39 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,0,0,0,0,0|4,0,0]=4 40 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,0,0,0,0,0|3,0,0]=3 41 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,0,0,0,0,0|2,0,0]=2 42 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,0,0,0,0,0|3,0,0]=3 43 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,0,0,0,0,0|3,0,0]=3 44 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,0,0,0,0,0|3,0,0]=3 45 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,0,0,0,0,0|3,0,0]=3 46 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,0,0,0,0,0|2,0,0]=2 47 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,0,0,0,0,0|3,0,0]=3 48 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,0,0,0,0,0|3,0,0]=3 49 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,0,0,0,0,0|1,0,0]=1 50 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,0,0,0,0,0|1,1,0]=2 51 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,0,0,0,0,0|1,1,0]=2 52 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,0,0,0,0,0|3,0,1]=4 53 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,0,0,0,0,0|3,0,1]=4 54 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,0,0,0,0,0|3,0,1]=4 55 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,0,0,0,0,0|3,0,1]=4 56 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,0,0,0,0,0|3,0,1]=4 57 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,0,0,0,0,0|3,0,1]=4 58 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,0,0,0,0,0|3,0,1]=4 59 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,0,0,0,0,0|2,0,2]=4 60 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,0,0,0,0,0|2,1,1]=4 61 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,0,0,0,0,0|2,0,2]=4 62 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,0,0,0,0,0|2,0,2]=4 63 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,0,0,0,0,0|4,0,0]=4 64 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,0,0,0,0,0|3,0,0]=3 65 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,0,0,0,0,0|4,0,0]=4 66 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,0,0,0,0,0|4,0,0]=4 67 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,0,0,0,0,0|4,0,0]=4 68 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,0,0,0,0,0|4,0,0]=4 69 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,0,0,0,0,0|3,0,0]=3 70 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,0,0,0,0,0|4,0,0]=4 71 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,0,0,0,0,0|4,0,0]=4 72 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,0,0,0,0,0|2,0,0]=2 73 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,0,0,0,0,0|4,0,0]=4 74 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,0,0,0,0,0|4,0,0]=4 75 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,0,0,0,0,0|4,0,0]=4 76 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,0,0,0,0,0|4,0,0]=4 77 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,0,0,0,0,0|4,0,0]=4 78 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,0,0,0,0,0|3,0,0]=3 79 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,0,0,0,0,0|4,0,0]=4 80 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,0,0,0,0,0|4,0,0]=4 81 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,0,0,0,0,0|4,0,0]=4 82 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,0,0,0,0,0|4,0,0]=4 83 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,0,0,0,0,0|4,0,0]=4 84 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,0,0,0,0,0|4,0,0]=4 85 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,0,0,0,0,0|4,0,0]=4 86 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,0,0,0,0,0|3,0,0]=3 87 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,0,0,0,0,0|4,0,0]=4 88 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,0,0,0,0,0|4,0,0]=4 89 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,0,0,0,0,0|2,0,0]=2 90 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,0,0,0,0,0|2,2,0]=4 91 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,0,0,0,0,0|4,0,0]=4 92 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,0,0,0,0,0|4,0,0]=4 93 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,0,0,0,0,0|4,0,0]=4 94 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,0,0,0,0,0|4,0,0]=4 95 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,0,0,0,0,0|4,0,0]=4 96 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,0,0,0,0,0|3,0,0]=3 97 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [0,0,0,0,0,0|2,1,1]=4 98 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [0,0,0,0,0,0|2,1,1]=4 99 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [0,0,0,0,0,0|2,1,1]=4 100 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [0,0,0,0,0,0|2,1,1]=4 101 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [0,0,0,0,0,0|2,1,1]=4 102 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [0,0,0,0,0,0|2,1,1]=4 103 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [0,0,0,0,0,0|2,1,1]=4 104 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [0,0,0,0,0,0|2,1,1]=4 105 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,0,0,0,0,0|3,0,0]=3 106 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,0,0,0,0,0|3,0,0]=3 107 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,0,0,0,0,0|3,0,0]=3 108 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,0,0,0,0,0|3,0,0]=3 109 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,0,0,0,0,0|3,0,0]=3 110 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,0,0,0,0,0|3,0,0]=3 111 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,0,0,0,0,0|3,0,0]=3 112 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,0,0,0,0,0|2,1,0]=3 113 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,0,0,0,0,0|2,1,0]=3 114 B6R0.1 CNC(C)COC MCULE-6864731576 [0,0,0,0,0,0|2,1,1]=4 115 B6R0.1 CNC(C)COC MCULE-9135013355 [0,0,0,0,0,0|2,1,1]=4 116 B6R0.1 CNC(C)CSC MCULE-8293407208 [0,0,0,0,0,0|2,0,1]=3 117 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,0,0,0,0,0|2,0,0]=2 118 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,0,0,0,0,0|2,0,0]=2 119 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,0,0,0,0,0|3,0,0]=3 120 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,0,0,0,0,0|1,0,0]=1 121 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,0,0,0,0,0|1,0,0]=1 122 B6R0.1 CNCC(C)OC MCULE-6977139114 [0,0,0,0,0,0|2,0,1]=3 123 B6R0.1 CNCC(C)OC MCULE-8216810034 [0,0,0,0,0,0|2,0,1]=3 124 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,0,0,0,0,0|2,0,0]=2 125 B6R0.1 CO/C(=N/C#N)/C MCULE-8775744872 [0,0,0,0,0,0|4,0,0]=4 126 B6R0.1 COC(=N)CC#N MCULE-1828487034 [0,0,0,0,0,0|3,0,0]=3 127 B6R0.1 COC(=N)CC#N MCULE-5000327296 [0,0,0,0,0,0|3,0,0]=3 128 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,0,0,0,0,0|3,0,0]=3 129 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,0,0,0,0,0|3,0,0]=3 130 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,0,0,0,0,0|3,0,0]=3 131 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,0,0,0,0,0|3,0,0]=3 132 B6R0.1 COC(=NC#N)C MCULE-9412459367 [0,0,0,0,0,0|4,0,0]=4 133 B6R0.1 COC(=O)/C=C/Br MCULE-8282646495 [0,0,0,0,0,0|2,0,1]=3 134 B6R0.1 COC(=O)/C=C/I MCULE-2652779390 [0,0,0,0,0,0|2,0,1]=3 135 B6R0.1 COC(=O)/C=C\Br MCULE-8147758029 [0,0,0,0,0,0|2,0,1]=3 136 B6R0.1 COC(=O)/C=C\I MCULE-9091408550 [0,0,0,0,0,0|2,0,1]=3 137 B6R0.1 COC(=O)C#CBr MCULE-2452280844 [0,0,0,0,0,0|2,0,1]=3 138 B6R0.1 COC(=O)C#CI MCULE-2688506741 [0,0,0,0,0,0|2,0,1]=3 139 B6R0.1 COC(=O)C=CBr MCULE-6878439912 [0,0,0,0,0,0|2,0,1]=3 140 B6R0.1 COC(=O)C=CCl MCULE-6895925134 [0,0,0,0,0,0|2,0,1]=3 141 B6R0.1 COC(=O)C=CI MCULE-1616048599 [0,0,0,0,0,0|2,0,1]=3 142 B6R0.1 COC(=O)C=CN MCULE-4685220707 [0,0,0,0,0,0|2,0,1]=3 143 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,0,0,0,0,0|2,0,0]=2 144 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,0,0,0,0,0|2,0,0]=2 145 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,0,0,0,0,0|2,0,0]=2 146 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,0,0,0,0,0|2,0,0]=2 147 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,0,0,0,0,0|2,0,0]=2 148 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,0,0,0,0,0|2,0,0]=2 149 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,0,0,0,0,0|2,0,0]=2 150 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,0,0,0,0,0|2,0,0]=2 151 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,0,0,0,0,0|2,0,0]=2 152 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,0,0,0,0,0|2,0,0]=2 153 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,0,0,0,0,0|2,0,0]=2 154 B6R0.1 COC(=O)CON MCULE-4799038238 [0,0,0,0,0,0|1,1,0]=2 155 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,0,0,0,0,0|0,0,0]=0 156 B6R0.1 COC(=O)N=C=S MCULE-2981767233 [0,0,0,0,0,0|3,0,0]=3 157 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,0,0,0,0,0|3,0,0]=3 158 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,0,0,0,0,0|3,0,0]=3 159 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,0,0,0,0,0|3,0,0]=3 160 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.1 COC(C)CC=O MCULE-7243333697 [0,0,0,0,0,0|3,0,1]=4 162 B6R0.1 COC(C)CCN MCULE-8081876282 [0,0,0,0,0,0|3,0,1]=4 163 B6R0.1 COC(C)CCN MCULE-8892057529 [0,0,0,0,0,0|3,0,1]=4 164 B6R0.1 COC(C)CCO MCULE-7396381165 [0,0,0,0,0,0|3,0,1]=4 165 B6R0.1 COC/C(=N/O)/N MCULE-8214035702 [0,0,0,0,0,0|3,1,0]=4 166 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,0,0,0,0,0|1,1,0]=2 167 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,0,0,0,0,0|1,1,0]=2 168 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,0,0,0,0,0|2,1,0]=3 169 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,0,0,0,0,0|2,1,0]=3 170 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,0,0,0,0,0|0,1,0]=1 171 B6R0.1 COCC(C)OC MCULE-1583498700 [0,0,0,0,0,0|1,1,1]=3 172 B6R0.1 CON(C)CCN MCULE-9318319159 [0,0,0,0,0,0|4,0,0]=4 173 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,0,0,0,0,0|1,1,0]=2 174 B6R0.1 CSC/C(=N/O)/N MCULE-9599823795 [0,0,0,0,0,0|3,0,0]=3 175 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,0,0,0,0,0|2,0,0]=2 176 B6R0.1 CSCC(C)CN MCULE-4493405290 [0,0,0,0,0,0|3,0,1]=4 177 B6R0.1 CSCC(C)CO MCULE-3842820579 [0,0,0,0,0,0|3,0,1]=4 178 B6R0.1 CSCC(O)CO MCULE-6573013078 [0,0,0,0,0,0|2,0,2]=4 179 B6R0.1 N#CCC(=O)NN MCULE-9203133961 [0,0,0,0,0,0|4,0,0]=4 180 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,0,0,0,0,0|4,0,0]=4 181 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,0,0,0,0,0|4,0,0]=4 182 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,0,0,0,0,0|4,0,0]=4 183 B6R0.1 NNC(=O)CCS MCULE-9322963076 [0,0,0,0,0,0|4,0,0]=4 184 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [0,0,0,0,0,0|4,0,0]=4 185 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,0,0,0,0,0|4,0,0]=4 186 B5R0.1 C#CCC(=O)O MCULE-4680699666 [1,0,0,0,0,0|1,0,1]=3 187 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,0,0,0,0,0|2,0,1]=4 188 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,0,0,0,0,0|2,0,1]=4 189 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [1,0,0,0,0,0|1,0,1]=3 190 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [1,0,0,0,0,0|2,0,1]=4 191 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [1,0,0,0,0,0|2,0,1]=4 192 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [1,0,0,0,0,0|1,0,1]=3 193 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,0,0,0,0,0|1,1,1]=4 194 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,0,0,0,0,0|3,0,0]=4 195 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,0,0,0,0,0|2,0,0]=3 196 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,0,0,0,0,0|3,0,0]=4 197 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,0,0,0,0,0|3,0,0]=4 198 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,0,0,0,0,0|3,0,0]=4 199 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,0,0,0,0,0|3,0,0]=4 200 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,0,0,0,0,0|3,0,0]=4 201 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,0,0,0,0,0|2,0,0]=3 202 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,0,0,0,0,0|2,0,0]=3 203 B5R0.1 C=C(C)CNN MCULE-1117931770 [1,0,0,0,0,0|3,0,0]=4 204 B5R0.1 C=C(C)CON MCULE-2773974323 [1,0,0,0,0,0|2,1,0]=4 205 B5R0.1 C=C(C)CON MCULE-5978680243 [1,0,0,0,0,0|2,1,0]=4 206 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,0,0,0,0,0|3,0,0]=4 207 B5R0.1 C=CCC(=C)C MCULE-6294070836 [1,0,0,0,0,0|2,0,1]=4 208 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [1,0,0,0,0,0|2,0,1]=4 209 B5R0.1 C=CCC(=O)N MCULE-1205335257 [1,0,0,0,0,0|2,0,1]=4 210 B5R0.1 C=CCC(=O)O MCULE-6288979337 [1,0,0,0,0,0|1,0,1]=3 211 B5R0.1 C=CNC(=O)C MCULE-1260296806 [1,0,0,0,0,0|2,0,1]=4 212 B5R0.1 C=COC(=O)C MCULE-7626795765 [1,0,0,0,0,0|2,0,1]=4 213 B5R0.1 C=NCC(=O)N MCULE-7609497329 [1,0,0,0,0,0|2,0,1]=4 214 B5R0.1 CC#CC(=O)C MCULE-4083248904 [1,0,0,0,0,0|1,0,1]=3 215 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [1,0,0,0,0,0|2,0,1]=4 216 B5R0.1 CC#CC(=O)O MCULE-9994142213 [1,0,0,0,0,0|1,0,1]=3 217 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [1,0,0,0,0,0|2,0,1]=4 218 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [1,0,0,0,0,0|2,0,1]=4 219 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [1,0,0,0,0,0|2,0,1]=4 220 B5R0.1 CC(=O)C=NO MCULE-5513006918 [1,0,0,0,0,0|2,0,1]=4 221 B5R0.1 CC(=O)CC#N MCULE-7203242552 [1,0,0,0,0,0|2,0,0]=3 222 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,0,0,0,0,0|2,0,0]=3 223 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,0,0,0,0,0|2,0,0]=3 224 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,0,0,0,0,0|2,0,0]=3 225 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,0,0,0,0,0|2,0,0]=3 226 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,0,0,0,0,0|2,0,0]=3 227 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [1,0,0,0,0,0|3,0,0]=4 228 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [1,0,0,0,0,0|2,0,1]=4 229 B5R0.1 CC(=O)NC#N MCULE-8444599659 [1,0,0,0,0,0|3,0,0]=4 230 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,0,0,0,0,0|3,0,0]=4 231 B5R0.1 CC(=O)OCBr MCULE-9842804945 [1,0,0,0,0,0|3,0,0]=4 232 B5R0.1 CC(=O)OCCl MCULE-6822222026 [1,0,0,0,0,0|3,0,0]=4 233 B5R0.1 CC(=O)SCBr MCULE-9794607323 [1,0,0,0,0,0|3,0,0]=4 234 B5R0.1 CC=CC(=O)C MCULE-4826977340 [1,0,0,0,0,0|1,0,1]=3 235 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [1,0,0,0,0,0|2,0,1]=4 236 B5R0.1 CC=CC(=O)N MCULE-9693879476 [1,0,0,0,0,0|2,0,1]=4 237 B5R0.1 CC=CC(=O)O MCULE-7970410217 [1,0,0,0,0,0|1,0,1]=3 238 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,0,0,0,0,0|2,0,1]=4 239 B5R0.1 CCCB(O)O MCULE-4994980798 [1,0,0,0,0,0|2,0,1]=4 240 B5R0.1 CCCC(=N)N MCULE-5974105638 [1,0,0,0,0,0|3,0,0]=4 241 B5R0.1 CCCC(=N)N MCULE-9230704591 [1,0,0,0,0,0|3,0,0]=4 242 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,0,0,0,0,0|1,0,0]=2 243 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,0,0,0,0,0|2,0,0]=3 244 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,0,0,0,0,0|2,0,0]=3 245 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,0,0,0,0,0|1,0,0]=2 246 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,0,0,0,0,0|1,0,1]=3 247 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,0,0,0,0,0|1,0,1]=3 248 B5R0.1 CCCC(=S)N MCULE-3529335988 [1,0,0,0,0,0|2,1,0]=4 249 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,0,0,0,0,0|1,1,0]=3 250 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,0,0,0,0,0|2,0,1]=4 251 B5R0.1 CCCC(C)C MCULE-9604552974 [1,0,0,0,0,0|2,0,1]=4 252 B5R0.1 CCCC(C)N MCULE-2640298430 [1,0,0,0,0,0|2,0,1]=4 253 B5R0.1 CCCC(C)N MCULE-7225905167 [1,0,0,0,0,0|2,0,1]=4 254 B5R0.1 CCCC(C)O MCULE-8205906299 [1,0,0,0,0,0|1,0,2]=4 255 B5R0.1 CCCC(C)S MCULE-1649095713 [1,0,0,0,0,0|1,1,1]=4 256 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,0,0,0,0,0|2,0,1]=4 257 B5R0.1 CCCN(=O)=O MCULE-5615753372 [1,0,0,0,0,0|2,0,1]=4 258 B5R0.1 CCCN(C)C MCULE-8702643596 [1,0,0,0,0,0|3,0,0]=4 259 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [1,0,0,0,0,0|2,0,1]=4 260 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [1,0,0,0,0,0|2,0,1]=4 261 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,0,0,0,0,0|2,0,1]=4 262 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,0,0,0,0,0|2,0,1]=4 263 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,0,0,0,0,0|2,0,1]=4 264 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,0,0,0,0,0|2,0,1]=4 265 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,0,0,0,0,0|1,0,2]=4 266 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,0,0,0,0,0|2,0,1]=4 267 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,0,0,0,0,0|2,0,1]=4 268 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,0,0,0,0,0|2,0,1]=4 269 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,0,0,0,0,0|2,0,1]=4 270 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,0,0,0,0,0|1,0,2]=4 271 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,0,0,0,0,0|2,0,0]=3 272 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [1,0,0,0,0,0|3,0,0]=4 273 B5R0.1 CCNC(=O)N MCULE-1913599861 [1,0,0,0,0,0|3,0,0]=4 274 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,0,0,0,0,0|3,0,0]=4 275 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,0,0,0,0,0|3,0,0]=4 276 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,0,0,0,0,0|2,0,0]=3 277 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [1,0,0,0,0,0|3,0,0]=4 278 B5R0.1 CCOC(=O)N MCULE-1776877276 [1,0,0,0,0,0|3,0,0]=4 279 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,0,0,0,0,0|2,1,0]=4 280 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,0,0,0,0,0|2,0,0]=3 281 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,0,0,0,0,0|2,1,0]=4 282 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,0,0,0,0,0|1,0,0]=2 283 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,0,0,0,0,0|1,0,0]=2 284 B5R0.1 CNCC(=O)N MCULE-2328887394 [1,0,0,0,0,0|2,0,0]=3 285 B5R0.1 CNCC(=O)N MCULE-3031605853 [1,0,0,0,0,0|2,0,0]=3 286 B5R0.1 CNCC(=O)N MCULE-7300977677 [1,0,0,0,0,0|2,0,0]=3 287 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,0,0,0,0,0|1,0,0]=2 288 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,0,0,0,0,0|1,0,0]=2 289 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [1,0,0,0,0,0|1,0,1]=3 290 B5R0.1 CNCC(C)C MCULE-6582386339 [1,0,0,0,0,0|2,0,1]=4 291 B5R0.1 CNCC(C)C MCULE-6856717783 [1,0,0,0,0,0|2,0,1]=4 292 B5R0.1 CNCC(C)F MCULE-4381138647 [1,0,0,0,0,0|2,0,1]=4 293 B5R0.1 CNCC(C)F MCULE-9018181183 [1,0,0,0,0,0|2,0,1]=4 294 B5R0.1 CNCC(C)O MCULE-3671071529 [1,0,0,0,0,0|1,0,2]=4 295 B5R0.1 CNCC(C)O MCULE-4171705304 [1,0,0,0,0,0|1,0,2]=4 296 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,0,0,0,0,0|1,0,2]=4 297 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,0,0,0,0,0|1,0,2]=4 298 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,0,0,0,0,0|1,0,2]=4 299 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,0,0,0,0,0|1,0,2]=4 300 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,0,0,0,0,0|1,0,2]=4 301 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,0,0,0,0,0|1,0,2]=4 302 B5R0.1 CNN=C(C)C MCULE-6307375856 [1,0,0,0,0,0|3,0,0]=4 303 B5R0.1 CNOC(=O)C MCULE-1464426541 [1,0,0,0,0,0|2,0,0]=3 304 B5R0.1 CNOC(=O)C MCULE-2976282666 [1,0,0,0,0,0|2,0,0]=3 305 B5R0.1 COC=C(C)C MCULE-6348538911 [1,0,0,0,0,0|1,1,1]=4 306 B5R0.1 COCC(=N)N MCULE-4711728356 [1,0,0,0,0,0|2,1,0]=4 307 B5R0.1 COCC(=N)N MCULE-7163250467 [1,0,0,0,0,0|2,1,0]=4 308 B5R0.1 COCC(=O)C MCULE-7262197587 [1,0,0,0,0,0|0,1,0]=2 309 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,0,0,0,0,0|1,1,0]=3 310 B5R0.1 COCC(=O)N MCULE-6674958132 [1,0,0,0,0,0|1,1,0]=3 311 B5R0.1 COCC(=O)O MCULE-3945589151 [1,0,0,0,0,0|0,1,0]=2 312 B5R0.1 COCC(=S)N MCULE-2046809269 [1,0,0,0,0,0|1,2,0]=4 313 B5R0.1 COCC(C)Br MCULE-6850689931 [1,0,0,0,0,0|1,1,1]=4 314 B5R0.1 COCC(C)I MCULE-8608265714 [1,0,0,0,0,0|1,1,1]=4 315 B5R0.1 COCC(C)N MCULE-1896873634 [1,0,0,0,0,0|1,1,1]=4 316 B5R0.1 COCC(C)N MCULE-2549420211 [1,0,0,0,0,0|1,1,1]=4 317 B5R0.1 COCC(C)N MCULE-3490410444 [1,0,0,0,0,0|1,1,1]=4 318 B5R0.1 COCC(C)N MCULE-7089888882 [1,0,0,0,0,0|1,1,1]=4 319 B5R0.1 COCC(C)O MCULE-4022733014 [1,0,0,0,0,0|0,1,2]=4 320 B5R0.1 COCC(C)O MCULE-7513310960 [1,0,0,0,0,0|0,1,2]=4 321 B5R0.1 COCN(C)C MCULE-1963225930 [1,0,0,0,0,0|2,1,0]=4 322 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,0,0,0,0,0|1,1,1]=4 323 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,0,0,0,0,0|1,1,1]=4 324 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,0,0,0,0,0|1,1,1]=4 325 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,0,0,0,0,0|1,1,1]=4 326 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,0,0,0,0,0|0,1,2]=4 327 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,0,0,0,0,0|0,1,2]=4 328 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,0,0,0,0,0|1,1,1]=4 329 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,0,0,0,0,0|1,1,1]=4 330 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,0,0,0,0,0|1,1,1]=4 331 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,0,0,0,0,0|1,1,1]=4 332 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,0,0,0,0,0|0,1,2]=4 333 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,0,0,0,0,0|0,1,2]=4 334 B5R0.1 CONC(=O)C MCULE-6601866630 [1,0,0,0,0,0|1,1,0]=3 335 B5R0.1 CONC(=O)N MCULE-3063713861 [1,0,0,0,0,0|2,1,0]=4 336 B5R0.1 CONC(=S)C MCULE-1876042939 [1,0,0,0,0,0|1,2,0]=4 337 B5R0.1 CS(=O)CC#N MCULE-1246621507 [1,0,0,0,0,0|3,0,0]=4 338 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,0,0,0,0,0|3,0,0]=4 339 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,0,0,0,0,0|3,0,0]=4 340 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,0,0,0,0,0|3,0,0]=4 341 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,0,0,0,0,0|3,0,0]=4 342 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,0,0,0,0,0|3,0,0]=4 343 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,0,0,0,0,0|3,0,0]=4 344 B5R0.1 CSC=[N+](C)C MCULE-3818988576 [1,0,0,0,0,0|2,0,1]=4 345 B5R0.1 CSC=[N+](C)C MCULE-8015580251 [1,0,0,0,0,0|2,0,1]=4 346 B5R0.1 CSCC(=N)N MCULE-7800929509 [1,0,0,0,0,0|2,0,0]=3 347 B5R0.1 CSCC(=N)N MCULE-8499985777 [1,0,0,0,0,0|2,0,0]=3 348 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,0,0,0,0,0|0,0,0]=1 349 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [1,0,0,0,0,0|1,0,0]=2 350 B5R0.1 CSCC(=O)N MCULE-4865579476 [1,0,0,0,0,0|1,0,0]=2 351 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,0,0,0,0,0|0,0,0]=1 352 B5R0.1 CSCC(=S)N MCULE-5029100305 [1,0,0,0,0,0|1,1,0]=3 353 B5R0.1 CSCC(C)N MCULE-7985946030 [1,0,0,0,0,0|1,0,1]=3 354 B5R0.1 CSCC(C)O MCULE-2227652351 [1,0,0,0,0,0|0,0,2]=3 355 B5R0.1 CSCN(C)C MCULE-2931143051 [1,0,0,0,0,0|2,0,0]=3 356 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,0,0,0,0,0|1,0,0]=2 357 B5R0.1 CSNC(=O)C MCULE-7350061514 [1,0,0,0,0,0|1,0,0]=2 358 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,0,0,0,0,0|3,0,0]=4 359 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [1,0,0,0,0,0|3,0,0]=4 360 B5R0.1 N#CCC(=O)N MCULE-8538286230 [1,0,0,0,0,0|3,0,0]=4 361 B5R0.1 N#CCC(=O)O MCULE-3440765061 [1,0,0,0,0,0|2,0,0]=3 362 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [1,0,0,0,0,0|2,0,1]=4 363 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [1,0,0,0,0,0|2,0,1]=4 364 B5R0.1 NC(=O)CCBr MCULE-3930714776 [1,0,0,0,0,0|3,0,0]=4 365 B5R0.1 NC(=O)CCCl MCULE-8300320959 [1,0,0,0,0,0|3,0,0]=4 366 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,0,0,0,0,0|3,0,0]=4 367 B5R0.1 NC(=O)CCS MCULE-7451827717 [1,0,0,0,0,0|3,0,0]=4 368 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [1,0,0,0,0,0|3,0,0]=4 369 B5R0.1 NCCC(=O)N MCULE-2899414135 [1,0,0,0,0,0|3,0,0]=4 370 B5R0.1 NCCC(=O)N MCULE-6993286668 [1,0,0,0,0,0|3,0,0]=4 371 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,0,0,0,0,0|2,0,0]=3 372 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,0,0,0,0,0|2,0,0]=3 373 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,0,0,0,0,0|2,0,0]=3 374 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [1,0,0,0,0,0|2,0,1]=4 375 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,0,0,0,0,0|3,0,0]=4 376 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,0,0,0,0,0|3,0,0]=4 377 B5R0.1 NNCC(=O)N MCULE-2794619708 [1,0,0,0,0,0|3,0,0]=4 378 B5R0.1 NNCC(=O)N MCULE-6773156087 [1,0,0,0,0,0|3,0,0]=4 379 B5R0.1 NNCC(=O)O MCULE-4908184724 [1,0,0,0,0,0|2,0,0]=3 380 B5R0.1 NNCC(=O)O MCULE-6315598774 [1,0,0,0,0,0|2,0,0]=3 381 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,0,0,0,0,0|1,1,0]=3 382 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,0,0,0,0,0|1,1,0]=3 383 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,0,0,0,0,0|1,1,0]=3 384 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [1,0,0,0,0,0|3,0,0]=4 385 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [1,0,0,0,0,0|3,0,0]=4 386 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [1,0,0,0,0,0|3,0,0]=4 387 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [1,0,0,0,0,0|2,0,1]=4 388 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [1,0,0,0,0,0|2,0,1]=4 389 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [1,0,0,0,0,0|2,0,1]=4 390 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [1,0,0,0,0,0|2,0,1]=4 391 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [1,0,0,0,0,0|2,0,1]=4 392 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [1,0,0,0,0,0|2,0,1]=4 393 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [1,0,0,0,0,0|2,0,1]=4 394 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [1,0,0,0,0,0|2,0,1]=4 395 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [1,0,0,0,0,0|2,0,1]=4 396 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [1,0,0,0,0,0|2,0,1]=4 397 B5R0.1 O=C(O)C=CI MCULE-7162332129 [1,0,0,0,0,0|2,0,1]=4 398 B5R0.1 O=C(O)C=NO MCULE-2039309679 [1,0,0,0,0,0|2,0,1]=4 399 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,0,0,0,0,0|2,0,0]=3 400 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,0,0,0,0,0|2,0,0]=3 401 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,0,0,0,0,0|2,0,0]=3 402 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,0,0,0,0,0|2,0,0]=3 403 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,0,0,0,0,0|2,0,0]=3 404 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,0,0,0,0,0|2,0,0]=3 405 B5R0.1 O=C(O)CNO MCULE-4437067339 [1,0,0,0,0,0|2,0,0]=3 406 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,0,0,0,0,0|2,0,1]=4 407 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,0,0,0,0,0|1,0,2]=4 408 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,0,0,0,0,0|1,0,2]=4 409 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,0,0,0,0,0|1,0,2]=4 410 B5R0.2 C#CCCOC MCULE-7152168835 [1,0,0,0,0,0|1,0,2]=4 411 B5R0.2 C#CCNOC MCULE-3336529831 [1,0,0,0,0,0|2,0,1]=4 412 B5R0.2 C#CCNOC MCULE-7807129420 [1,0,0,0,0,0|2,0,1]=4 413 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [1,0,0,0,0,0|2,0,1]=4 414 B5R0.2 C/C=C/CC#N MCULE-3707973146 [1,0,0,0,0,0|3,0,0]=4 415 B5R0.2 C/C=C/CCC MCULE-9851656818 [1,0,0,0,0,0|2,0,0]=3 416 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,0,0,0,0,0|3,0,0]=4 417 B5R0.2 C/C=C/OCC MCULE-2891896400 [1,0,0,0,0,0|3,0,0]=4 418 B5R0.2 C/C=C\CCC MCULE-1013657748 [1,0,0,0,0,0|2,0,0]=3 419 B5R0.2 C=CC/C=C/C MCULE-8732875285 [1,0,0,0,0,0|2,0,1]=4 420 B5R0.2 C=CCC=CC MCULE-8643449832 [1,0,0,0,0,0|2,0,1]=4 421 B5R0.2 C=CCCOC MCULE-4681354270 [1,0,0,0,0,0|1,0,2]=4 422 B5R0.2 CC#CCCC MCULE-8179328151 [1,0,0,0,0,0|2,0,1]=4 423 B5R0.2 CC#CCNC MCULE-3549759323 [1,0,0,0,0,0|2,0,1]=4 424 B5R0.2 CC#CCNC MCULE-7250319597 [1,0,0,0,0,0|2,0,1]=4 425 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,0,0,0,0,0|2,0,1]=4 426 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,0,0,0,0,0|2,0,1]=4 427 B5R0.2 CC=CC=CC MCULE-7702675183 [1,0,0,0,0,0|2,0,1]=4 428 B5R0.2 CC=CCC#N MCULE-6960681395 [1,0,0,0,0,0|3,0,0]=4 429 B5R0.2 CC=CCCBr MCULE-7329159278 [1,0,0,0,0,0|3,0,0]=4 430 B5R0.2 CC=CCCC MCULE-8736231124 [1,0,0,0,0,0|2,0,0]=3 431 B5R0.2 CC=CCCN MCULE-5129102475 [1,0,0,0,0,0|3,0,0]=4 432 B5R0.2 CC=CCCN MCULE-8500001929 [1,0,0,0,0,0|3,0,0]=4 433 B5R0.2 CC=CCCO MCULE-4302367089 [1,0,0,0,0,0|3,0,0]=4 434 B5R0.2 CC=COCC MCULE-1473170404 [1,0,0,0,0,0|3,0,0]=4 435 B5R0.2 CC=CSSC MCULE-2442770677 [1,0,0,0,0,0|2,0,0]=3 436 B5R0.2 CCC=CCC MCULE-5435957422 [1,0,0,0,0,0|2,0,1]=4 437 B5R0.2 CCCC=NO MCULE-7364375780 [1,0,0,0,0,0|3,0,0]=4 438 B5R0.2 CCCCCC MCULE-3465692202 [1,0,0,0,0,0|2,0,1]=4 439 B5R0.2 CCCCNC MCULE-9321610906 [1,0,0,0,0,0|2,0,1]=4 440 B5R0.2 CCCCOC MCULE-9814272675 [1,0,0,0,0,0|1,0,1]=3 441 B5R0.2 CCCCON MCULE-7582349983 [1,0,0,0,0,0|2,0,1]=4 442 B5R0.2 CCCCON MCULE-8175627798 [1,0,0,0,0,0|2,0,1]=4 443 B5R0.2 CCCCSC MCULE-2799775567 [1,0,0,0,0,0|1,0,1]=3 444 B5R0.2 CCCNCC MCULE-7948828264 [1,0,0,0,0,0|3,0,0]=4 445 B5R0.2 CCCNCC MCULE-9107549207 [1,0,0,0,0,0|3,0,0]=4 446 B5R0.2 CCCOCC MCULE-9971916790 [1,0,0,0,0,0|3,0,0]=4 447 B5R0.2 CCCSCC MCULE-4547385568 [1,0,0,0,0,0|3,0,0]=4 448 B5R0.2 CCCSSC MCULE-3127072032 [1,0,0,0,0,0|2,0,1]=4 449 B5R0.2 CNCCNC MCULE-1378979868 [1,0,0,0,0,0|2,0,1]=4 450 B5R0.2 CNCCNC MCULE-3281508478 [1,0,0,0,0,0|2,0,1]=4 451 B5R0.2 CNCCOC MCULE-2857904484 [1,0,0,0,0,0|1,0,1]=3 452 B5R0.2 CNCCOC MCULE-5342712496 [1,0,0,0,0,0|1,0,1]=3 453 B5R0.2 CNCCSC MCULE-2812984399 [1,0,0,0,0,0|1,0,1]=3 454 B5R0.2 CNCCSC MCULE-2942435951 [1,0,0,0,0,0|1,0,1]=3 455 B5R0.2 COC=CC#N MCULE-4212629233 [1,0,0,0,0,0|2,0,1]=4 456 B5R0.2 COCCC#N MCULE-3009737584 [1,0,0,0,0,0|2,0,1]=4 457 B5R0.2 COCCC=O MCULE-2812117208 [1,0,0,0,0,0|2,0,1]=4 458 B5R0.2 COCCCBr MCULE-6489536401 [1,0,0,0,0,0|2,0,1]=4 459 B5R0.2 COCCCCl MCULE-9192274624 [1,0,0,0,0,0|2,0,1]=4 460 B5R0.2 COCCCF MCULE-5055725246 [1,0,0,0,0,0|2,0,1]=4 461 B5R0.2 COCCCI MCULE-9111605439 [1,0,0,0,0,0|2,0,1]=4 462 B5R0.2 COCCCN MCULE-1421362990 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.2 COCCCN MCULE-4783132205 [1,0,0,0,0,0|2,0,1]=4 464 B5R0.2 COCCCO MCULE-4041418048 [1,0,0,0,0,0|2,0,1]=4 465 B5R0.2 COCCCS MCULE-2371333731 [1,0,0,0,0,0|2,0,1]=4 466 B5R0.2 COCCNN MCULE-2086510453 [1,0,0,0,0,0|2,0,1]=4 467 B5R0.2 COCCNN MCULE-4830987822 [1,0,0,0,0,0|2,0,1]=4 468 B5R0.2 COCCNN MCULE-8361975855 [1,0,0,0,0,0|2,0,1]=4 469 B5R0.2 COCCOC MCULE-7572196731 [1,0,0,0,0,0|0,1,1]=3 470 B5R0.2 COCCON MCULE-3507489398 [1,0,0,0,0,0|1,1,1]=4 471 B5R0.2 COCCON MCULE-8506879697 [1,0,0,0,0,0|1,1,1]=4 472 B5R0.2 COCCSC MCULE-5362054021 [1,0,0,0,0,0|0,0,1]=2 473 B5R0.2 CONCCN MCULE-3332727097 [1,0,0,0,0,0|3,0,0]=4 474 B5R0.2 CONCCN MCULE-5066538639 [1,0,0,0,0,0|3,0,0]=4 475 B5R0.2 CONCCO MCULE-9787830121 [1,0,0,0,0,0|3,0,0]=4 476 B5R0.2 CSCCC#N MCULE-5755086116 [1,0,0,0,0,0|2,0,1]=4 477 B5R0.2 CSCCC=O MCULE-6273241704 [1,0,0,0,0,0|2,0,1]=4 478 B5R0.2 CSCCCBr MCULE-8399851816 [1,0,0,0,0,0|2,0,1]=4 479 B5R0.2 CSCCCCl MCULE-1829120476 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.2 CSCCCN MCULE-1030938424 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.2 CSCCCN MCULE-4664984921 [1,0,0,0,0,0|2,0,1]=4 482 B5R0.2 CSCCCO MCULE-9232413185 [1,0,0,0,0,0|2,0,1]=4 483 B5R0.2 CSCCCS MCULE-8405766359 [1,0,0,0,0,0|2,0,1]=4 484 B5R0.2 CSCCON MCULE-9125601960 [1,0,0,0,0,0|1,0,1]=3 485 B5R0.3 C#CC(=O)CC MCULE-1563732373 [1,0,0,0,0,0|1,0,1]=3 486 B5R0.3 C#CC(=O)NC MCULE-8852565705 [1,0,0,0,0,0|1,0,2]=4 487 B5R0.3 C#CC(=O)OC MCULE-5108326717 [1,0,0,0,0,0|0,0,2]=3 488 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,0,0,0,0,0|2,0,0]=3 489 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,0,0,0,0,0|2,0,0]=3 490 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [1,0,0,0,0,0|2,0,0]=3 491 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [1,0,0,0,0,0|2,0,0]=3 492 B5R0.3 C=C(C=O)CC MCULE-2875154067 [1,0,0,0,0,0|3,0,0]=4 493 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,0,0,0,0,0|3,0,0]=4 494 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,0,0,0,0,0|2,0,0]=3 495 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,0,0,0,0,0|3,0,0]=4 496 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,0,0,0,0,0|3,0,0]=4 497 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,0,0,0,0,0|2,1,0]=4 498 B5R0.3 C=C(SC)SC MCULE-8497326619 [1,0,0,0,0,0|1,1,0]=3 499 B5R0.3 C=CC(=O)CC MCULE-7277696617 [1,0,0,0,0,0|1,0,1]=3 500 B5R0.3 C=CC(=O)NC MCULE-5619481947 [1,0,0,0,0,0|1,0,2]=4 501 B5R0.3 C=CC(=O)OC MCULE-6010665978 [1,0,0,0,0,0|0,0,2]=3 502 B5R0.3 CC(=NO)CS MCULE-9694340512 [1,0,0,0,0,0|3,0,0]=4 503 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,0,0,0,0,0|3,0,0]=4 504 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [1,0,0,0,0,0|3,0,0]=4 505 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [1,0,0,0,0,0|3,0,0]=4 506 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,0,0,0,0,0|2,0,0]=3 507 B5R0.3 CC=C(C)CCl MCULE-2444762050 [1,0,0,0,0,0|3,0,0]=4 508 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,0,0,0,0,0|1,0,0]=2 509 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,0,0,0,0,0|1,0,0]=2 510 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,0,0,0,0,0|3,0,0]=4 511 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,0,0,0,0,0|2,0,0]=3 512 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,0,0,0,0,0|1,0,0]=2 513 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,0,0,0,0,0|2,0,0]=3 514 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,0,0,0,0,0|2,0,0]=3 515 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,0,0,0,0,0|2,0,0]=3 516 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,0,0,0,0,0|1,1,0]=3 517 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,0,0,0,0,0|1,0,0]=2 518 B5R0.3 CCC(=O)NN MCULE-1803705917 [1,0,0,0,0,0|2,0,0]=3 519 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,0,0,0,0,0|2,0,0]=3 520 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,0,0,0,0,0|0,0,0]=1 521 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,0,0,0,0,0|0,1,0]=2 522 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,0,0,0,0,0|2,0,1]=4 523 B5R0.3 CCC(C)CC MCULE-2542807917 [1,0,0,0,0,0|2,0,1]=4 524 B5R0.3 CCC(C)CS MCULE-7795095685 [1,0,0,0,0,0|2,0,1]=4 525 B5R0.3 CCC(C)NC MCULE-2676584804 [1,0,0,0,0,0|2,0,1]=4 526 B5R0.3 CCC(C)NC MCULE-6158046887 [1,0,0,0,0,0|2,0,1]=4 527 B5R0.3 CCC(C)OC MCULE-7354431606 [1,0,0,0,0,0|1,0,1]=3 528 B5R0.3 CCC(C)ON MCULE-2907890438 [1,0,0,0,0,0|2,0,1]=4 529 B5R0.3 CCC(C)ON MCULE-4364205813 [1,0,0,0,0,0|2,0,1]=4 530 B5R0.3 CCC(I)CC MCULE-1119844552 [1,0,0,0,0,0|2,0,1]=4 531 B5R0.3 CCC(N)CC MCULE-4261937519 [1,0,0,0,0,0|2,0,1]=4 532 B5R0.3 CCC(N)CC MCULE-5899128891 [1,0,0,0,0,0|2,0,1]=4 533 B5R0.3 CCC(O)CC MCULE-5553645045 [1,0,0,0,0,0|1,0,2]=4 534 B5R0.3 CCC(S)CC MCULE-2556259434 [1,0,0,0,0,0|1,1,1]=4 535 B5R0.3 CCC(S)CS MCULE-9332449950 [1,0,0,0,0,0|1,1,1]=4 536 B5R0.3 CCN(C)CC MCULE-7207964917 [1,0,0,0,0,0|3,0,0]=4 537 B5R0.3 CCN(N)CC MCULE-9853386945 [1,0,0,0,0,0|3,0,0]=4 538 B5R0.3 CCN(N)CC MCULE-9962617398 [1,0,0,0,0,0|3,0,0]=4 539 B5R0.3 CCN(O)CC MCULE-6022935768 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,0,0,0,0,0|2,0,0]=3 541 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,0,0,0,0,0|3,0,0]=4 542 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,0,0,0,0,0|2,0,0]=3 543 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,0,0,0,0,0|2,1,0]=4 544 B5R0.3 CNC(=N)NC MCULE-7703075263 [1,0,0,0,0,0|3,0,0]=4 545 B5R0.3 CNC(=O)CBr MCULE-1439209307 [1,0,0,0,0,0|2,0,0]=3 546 B5R0.3 CNC(=O)CCl MCULE-1437904095 [1,0,0,0,0,0|2,0,0]=3 547 B5R0.3 CNC(=O)CI MCULE-1687694185 [1,0,0,0,0,0|2,0,0]=3 548 B5R0.3 CNC(=O)CN MCULE-1901033297 [1,0,0,0,0,0|2,0,0]=3 549 B5R0.3 CNC(=O)CN MCULE-8532774234 [1,0,0,0,0,0|2,0,0]=3 550 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,0,0,0,0,0|1,1,0]=3 551 B5R0.3 CNC(=O)CS MCULE-7032391129 [1,0,0,0,0,0|1,0,0]=2 552 B5R0.3 CNC(=O)NC MCULE-5319497155 [1,0,0,0,0,0|2,0,0]=3 553 B5R0.3 CNC(=O)NN MCULE-2093843774 [1,0,0,0,0,0|3,0,0]=4 554 B5R0.3 CNC(=O)OC MCULE-1162861376 [1,0,0,0,0,0|1,0,0]=2 555 B5R0.3 CNC(=S)NC MCULE-7998520647 [1,0,0,0,0,0|2,1,0]=4 556 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,0,0,0,0,0|2,0,0]=3 557 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,0,0,0,0,0|2,0,0]=3 558 B5R0.3 COC(=O)C#N MCULE-8762838190 [1,0,0,0,0,0|1,0,1]=3 559 B5R0.3 COC(=O)C=O MCULE-2685327079 [1,0,0,0,0,0|0,1,1]=3 560 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,0,0,0,0,0|1,0,0]=2 561 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,0,0,0,0,0|1,0,0]=2 562 B5R0.3 COC(=O)CF MCULE-4367430175 [1,0,0,0,0,0|1,0,0]=2 563 B5R0.3 COC(=O)CI MCULE-9545584156 [1,0,0,0,0,0|1,0,0]=2 564 B5R0.3 COC(=O)CN MCULE-7462799100 [1,0,0,0,0,0|1,0,0]=2 565 B5R0.3 COC(=O)CN MCULE-8887061469 [1,0,0,0,0,0|1,0,0]=2 566 B5R0.3 COC(=O)CO MCULE-8734582763 [1,0,0,0,0,0|0,1,0]=2 567 B5R0.3 COC(=O)CS MCULE-3020830180 [1,0,0,0,0,0|0,0,0]=1 568 B5R0.3 COC(=O)NN MCULE-2637794839 [1,0,0,0,0,0|2,0,0]=3 569 B5R0.3 COC(=O)OC MCULE-7488725621 [1,0,0,0,0,0|0,1,0]=2 570 B5R0.3 COC(=O)SCl MCULE-1018411491 [1,0,0,0,0,0|1,0,0]=2 571 B5R0.3 COC(=S)NN MCULE-8717505617 [1,0,0,0,0,0|2,1,0]=4 572 B5R0.3 COC(=S)SC MCULE-7665194168 [1,0,0,0,0,0|0,1,0]=2 573 B5R0.3 COC(C)CBr MCULE-6831960550 [1,0,0,0,0,0|2,0,1]=4 574 B5R0.3 COC(C)CCl MCULE-6614968111 [1,0,0,0,0,0|2,0,1]=4 575 B5R0.3 COC(C)CI MCULE-9561627722 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.3 COC(C)CN MCULE-1378513525 [1,0,0,0,0,0|2,0,1]=4 577 B5R0.3 COC(C)CN MCULE-6114730248 [1,0,0,0,0,0|2,0,1]=4 578 B5R0.3 COC(C)CN MCULE-7516064224 [1,0,0,0,0,0|2,0,1]=4 579 B5R0.3 COC(C)CN MCULE-8277408054 [1,0,0,0,0,0|2,0,1]=4 580 B5R0.3 COC(C)CO MCULE-5269990702 [1,0,0,0,0,0|1,1,1]=4 581 B5R0.3 COC(C)CO MCULE-7173093332 [1,0,0,0,0,0|1,1,1]=4 582 B5R0.3 COC(C)OC MCULE-8241616143 [1,0,0,0,0,0|1,1,1]=4 583 B5R0.3 COS(=O)OC MCULE-9352053920 [1,0,0,0,0,0|1,1,0]=3 584 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,0,0,0,0,0|2,0,1]=4 585 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,0,0,0,0,0|2,0,1]=4 586 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,0,0,0,0,0|2,0,1]=4 587 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,0,0,0,0,0|2,0,1]=4 588 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,0,0,0,0,0|1,1,1]=4 589 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,0,0,0,0,0|1,1,1]=4 590 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,0,0,0,0,0|2,0,1]=4 591 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,0,0,0,0,0|2,0,1]=4 592 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,0,0,0,0,0|2,0,1]=4 593 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,0,0,0,0,0|2,0,1]=4 594 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,0,0,0,0,0|1,1,1]=4 595 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,0,0,0,0,0|1,1,1]=4 596 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [1,0,0,0,0,0|3,0,0]=4 597 B5R0.3 CS/C(=N\N)/N MCULE-2245524081 [1,0,0,0,0,0|3,0,0]=4 598 B5R0.3 CS/C(=N\N)/N MCULE-6241847719 [1,0,0,0,0,0|3,0,0]=4 599 B5R0.3 CSC(=NO)C MCULE-1500524467 [1,0,0,0,0,0|3,0,0]=4 600 B5R0.3 CSC(=O)SC MCULE-7167992573 [1,0,0,0,0,0|0,1,0]=2 601 B5R0.3 CSC(=S)NN MCULE-2798461411 [1,0,0,0,0,0|2,1,0]=4 602 B5R0.3 CSC(=S)SC MCULE-5023087703 [1,0,0,0,0,0|0,2,0]=3 603 B5R0.3 NCC(=O)CN MCULE-2420991481 [1,0,0,0,0,0|3,0,0]=4 604 B5R0.3 NCC(=O)CN MCULE-8626789745 [1,0,0,0,0,0|3,0,0]=4 605 B5R0.3 NCC(=O)NN MCULE-2318099199 [1,0,0,0,0,0|3,0,0]=4 606 B5R0.3 NCC(=O)NN MCULE-3392354502 [1,0,0,0,0,0|3,0,0]=4 607 B5R0.3 NCC(=O)NO MCULE-5417617455 [1,0,0,0,0,0|3,0,0]=4 608 B5R0.3 NNC(=O)CCl MCULE-2158347473 [1,0,0,0,0,0|3,0,0]=4 609 B5R0.3 NNC(=O)CCl MCULE-9762553206 [1,0,0,0,0,0|3,0,0]=4 610 B5R0.3 NNC(=O)CO MCULE-8443636349 [1,0,0,0,0,0|2,1,0]=4 611 B5R0.3 NNC(=O)CS MCULE-4913925166 [1,0,0,0,0,0|2,0,0]=3 612 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [1,0,0,0,0,0|3,0,0]=4 613 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.3 O=C(CF)CF MCULE-8790300272 [1,0,0,0,0,0|3,0,0]=4 615 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,0,0,0,0,0|2,1,0]=4 616 B5R0.3 O=CC(=O)CO MCULE-7273475675 [1,0,0,0,0,0|2,1,0]=4 617 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [1,0,0,0,0,0|1,1,0]=3 618 B7R0.2 C=CC(=O)CC(C)C MCULE-2912404970 [0,1,0,0,0,0|2,0,1]=4 619 B7R0.2 CC(C)CC(=O)C#N MCULE-7628756423 [0,1,0,0,0,0|3,0,0]=4 620 B7R0.2 CC(C)CC(=O)CBr MCULE-3556695745 [0,1,0,0,0,0|3,0,0]=4 621 B7R0.2 CC(C)CC(=O)CCl MCULE-6858533367 [0,1,0,0,0,0|3,0,0]=4 622 B7R0.2 CC(C)CC(=O)CN MCULE-2435223768 [0,1,0,0,0,0|3,0,0]=4 623 B7R0.2 CC(C)CC(=O)CN MCULE-7131454463 [0,1,0,0,0,0|3,0,0]=4 624 B7R0.2 CC(C)CC(=O)NN MCULE-7719387931 [0,1,0,0,0,0|3,0,0]=4 625 B7R0.2 CC(O)CC(=O)NN MCULE-2521784411 [0,1,0,0,0,0|3,0,0]=4 626 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,1,0,0,0,0|2,0,0]=3 627 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,1,0,0,0,0|3,0,0]=4 628 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,1,0,0,0,0|2,0,0]=3 629 B7R0.2 CCC(=O)NC(C)C MCULE-3565002235 [0,1,0,0,0,0|3,0,0]=4 630 B7R0.2 CCC(=O)OC(=O)C MCULE-8264492254 [0,1,0,0,0,0|3,0,0]=4 631 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,1,0,0,0,0|3,0,0]=4 632 B7R0.2 CN(C)CC(=O)NN MCULE-4271340398 [0,1,0,0,0,0|3,0,0]=4 633 B7R0.2 CN(C)CC(=O)NN MCULE-8010840162 [0,1,0,0,0,0|3,0,0]=4 634 B7R0.2 CN(C)CC(=O)NN MCULE-9920503081 [0,1,0,0,0,0|3,0,0]=4 635 B7R0.2 CNC(=O)CC(=N)N MCULE-4798896062 [0,1,0,0,0,0|3,0,0]=4 636 B7R0.2 CNC(=O)CC(=N)N MCULE-6994336455 [0,1,0,0,0,0|3,0,0]=4 637 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [0,1,0,0,0,0|2,0,0]=3 638 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [0,1,0,0,0,0|3,0,0]=4 639 B7R0.2 CNC(=O)CC(=S)N MCULE-1637389152 [0,1,0,0,0,0|3,0,0]=4 640 B7R0.2 CNC(=O)CC(C)C MCULE-2303112628 [0,1,0,0,0,0|2,0,0]=3 641 B7R0.2 CNC(=O)CC(C)N MCULE-7773306348 [0,1,0,0,0,0|2,0,0]=3 642 B7R0.2 CNC(=O)CC(C)N MCULE-8658175271 [0,1,0,0,0,0|2,0,0]=3 643 B7R0.2 CNC(=O)CN(=O)=O MCULE-2253664059 [0,1,0,0,0,0|3,0,0]=4 644 B7R0.2 CNC(=O)NC(=O)C MCULE-9100713966 [0,1,0,0,0,0|3,0,0]=4 645 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [0,1,0,0,0,0|2,0,1]=4 646 B7R0.2 COC(=N)CC(C)C MCULE-4603041381 [0,1,0,0,0,0|2,0,0]=3 647 B7R0.2 COC(=N)CC(C)C MCULE-5838686710 [0,1,0,0,0,0|2,0,0]=3 648 B7R0.2 COC(=O)/C=C(/C)\N MCULE-2378404457 [0,1,0,0,0,0|1,0,1]=3 649 B7R0.2 COC(=O)/C=C(\C)/N MCULE-7223502425 [0,1,0,0,0,0|1,0,1]=3 650 B7R0.2 COC(=O)C=C(C)C MCULE-9357284649 [0,1,0,0,0,0|1,0,1]=3 651 B7R0.2 COC(=O)C=C(C)N MCULE-8452012306 [0,1,0,0,0,0|1,0,1]=3 652 B7R0.2 COC(=O)C=C(C)[O-] MCULE-2706789496 [0,1,0,0,0,0|1,0,1]=3 653 B7R0.2 COC(=O)C=C(C)[O-] MCULE-4482386969 [0,1,0,0,0,0|1,0,1]=3 654 B7R0.2 COC(=O)CC(=N)N MCULE-3622266378 [0,1,0,0,0,0|2,0,0]=3 655 B7R0.2 COC(=O)CC(=N)N MCULE-8717458518 [0,1,0,0,0,0|2,0,0]=3 656 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,1,0,0,0,0|1,0,0]=2 657 B7R0.2 COC(=O)CC(=O)Cl MCULE-5016603273 [0,1,0,0,0,0|2,0,0]=3 658 B7R0.2 COC(=O)CC(=O)N MCULE-7129379910 [0,1,0,0,0,0|2,0,0]=3 659 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [0,1,0,0,0,0|2,0,0]=3 660 B7R0.2 COC(=O)CC(=O)[O-] MCULE-4316322156 [0,1,0,0,0,0|2,0,0]=3 661 B7R0.2 COC(=O)CC(=S)N MCULE-3325362226 [0,1,0,0,0,0|2,0,0]=3 662 B7R0.2 COC(=O)CC(C)Br MCULE-4193147778 [0,1,0,0,0,0|1,0,0]=2 663 B7R0.2 COC(=O)CC(C)C MCULE-2808202854 [0,1,0,0,0,0|1,0,0]=2 664 B7R0.2 COC(=O)CC(C)Cl MCULE-2734734940 [0,1,0,0,0,0|1,0,0]=2 665 B7R0.2 COC(=O)CC(C)N MCULE-2402304310 [0,1,0,0,0,0|1,0,0]=2 666 B7R0.2 COC(=O)CC(C)N MCULE-3520358398 [0,1,0,0,0,0|1,0,0]=2 667 B7R0.2 COC(=O)CC(C)N MCULE-4044567169 [0,1,0,0,0,0|1,0,0]=2 668 B7R0.2 COC(=O)CC(C)N MCULE-5962991844 [0,1,0,0,0,0|1,0,0]=2 669 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,1,0,0,0,0|1,0,0]=2 670 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,1,0,0,0,0|1,0,0]=2 671 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,1,0,0,0,0|1,0,0]=2 672 B7R0.2 COC(=O)CN(=O)=O MCULE-9778666398 [0,1,0,0,0,0|2,0,0]=3 673 B7R0.2 COC(=O)CN(C)C MCULE-2035644817 [0,1,0,0,0,0|1,0,0]=2 674 B7R0.2 COC(=O)CN(C)C MCULE-2356820620 [0,1,0,0,0,0|1,0,0]=2 675 B7R0.2 COC(=O)CS(=O)C MCULE-6286293391 [0,1,0,0,0,0|0,0,1]=2 676 B7R0.2 COC(=O)C[C@@H](C)N MCULE-1483636974 [0,1,0,0,0,0|1,0,0]=2 677 B7R0.2 COC(=O)C[C@@H](C)N MCULE-4260923997 [0,1,0,0,0,0|1,0,0]=2 678 B7R0.2 COC(=O)C[C@@H](C)N MCULE-6569883717 [0,1,0,0,0,0|1,0,0]=2 679 B7R0.2 COC(=O)C[C@@H](C)N MCULE-9853158708 [0,1,0,0,0,0|1,0,0]=2 680 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,1,0,0,0,0|1,0,0]=2 681 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,1,0,0,0,0|1,0,0]=2 682 B7R0.2 COC(=O)C[C@H](C)N MCULE-1385999778 [0,1,0,0,0,0|1,0,0]=2 683 B7R0.2 COC(=O)C[C@H](C)N MCULE-1446150641 [0,1,0,0,0,0|1,0,0]=2 684 B7R0.2 COC(=O)C[C@H](C)N MCULE-2979603570 [0,1,0,0,0,0|1,0,0]=2 685 B7R0.2 COC(=O)C[C@H](C)N MCULE-7679126750 [0,1,0,0,0,0|1,0,0]=2 686 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,1,0,0,0,0|1,0,0]=2 687 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,1,0,0,0,0|1,0,0]=2 688 B7R0.2 COC(=O)NC(C)C MCULE-4552685948 [0,1,0,0,0,0|2,0,0]=3 689 B7R0.2 COC(=O)OC(C)C MCULE-4462394604 [0,1,0,0,0,0|2,0,0]=3 690 B7R0.2 COC(=O)SC(C)C MCULE-9908884347 [0,1,0,0,0,0|2,0,0]=3 691 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,1,0,0,0,0|2,0,1]=4 692 B7R0.2 CSC(=O)CC(C)C MCULE-5433173038 [0,1,0,0,0,0|1,1,0]=3 693 B7R0.3 C#CCCC(=O)OC MCULE-8778440511 [0,1,0,0,0,0|1,0,1]=3 694 B7R0.3 C#CCNC(=O)CC MCULE-2258533582 [0,1,0,0,0,0|2,0,1]=4 695 B7R0.3 C#CCNC(=O)NC MCULE-5171868572 [0,1,0,0,0,0|2,0,1]=4 696 B7R0.3 C#CCNC(=O)OC MCULE-3058580094 [0,1,0,0,0,0|1,0,1]=3 697 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,1,0,0,0,0|2,0,1]=4 698 B7R0.3 C#CCOC(=O)OC MCULE-7912235498 [0,1,0,0,0,0|1,0,1]=3 699 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,1,0,0,0,0|1,0,0]=2 700 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,1,0,0,0,0|3,0,0]=4 701 B7R0.3 C=CC(=O)CCCCl MCULE-7188402172 [0,1,0,0,0,0|2,0,1]=4 702 B7R0.3 C=CC(=O)NCCC MCULE-5704500398 [0,1,0,0,0,0|2,0,1]=4 703 B7R0.3 C=CC(=O)OCCC MCULE-5292603407 [0,1,0,0,0,0|2,0,1]=4 704 B7R0.3 C=CC=CC(=O)OC MCULE-1940821537 [0,1,0,0,0,0|1,0,2]=4 705 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,1,0,0,0,0|2,0,1]=4 706 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [0,1,0,0,0,0|2,0,1]=4 707 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,1,0,0,0,0|1,0,1]=3 708 B7R0.3 C=CCCC(=S)OC MCULE-4709907145 [0,1,0,0,0,0|1,1,1]=4 709 B7R0.3 C=CCOC(=O)OC MCULE-9416609870 [0,1,0,0,0,0|1,0,1]=3 710 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,1,0,0,0,0|1,0,0]=2 711 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [0,1,0,0,0,0|1,0,1]=3 712 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,1,0,0,0,0|1,0,0]=2 713 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,1,0,0,0,0|2,0,0]=3 714 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,1,0,0,0,0|2,0,0]=3 715 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,1,0,0,0,0|3,0,0]=4 716 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,1,0,0,0,0|3,0,0]=4 717 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,1,0,0,0,0|3,0,0]=4 718 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,1,0,0,0,0|3,0,0]=4 719 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,1,0,0,0,0|3,0,0]=4 720 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,1,0,0,0,0|3,0,0]=4 721 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,1,0,0,0,0|1,1,0]=3 722 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [0,1,0,0,0,0|1,0,1]=3 723 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,1,0,0,0,0|3,0,0]=4 724 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,1,0,0,0,0|2,0,0]=3 725 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,1,0,0,0,0|2,0,0]=3 726 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,1,0,0,0,0|3,0,0]=4 727 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,1,0,0,0,0|2,0,0]=3 728 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,1,0,0,0,0|3,0,0]=4 729 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,1,0,0,0,0|2,0,0]=3 730 B7R0.3 CCCCC(=O)NN MCULE-9535710488 [0,1,0,0,0,0|3,0,0]=4 731 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,1,0,0,0,0|1,0,0]=2 732 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,1,0,0,0,0|3,0,0]=4 733 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,1,0,0,0,0|3,0,0]=4 734 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,1,0,0,0,0|3,0,0]=4 735 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,1,0,0,0,0|3,0,0]=4 736 B7R0.3 CCCNC(=O)NN MCULE-9369722445 [0,1,0,0,0,0|3,0,0]=4 737 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,1,0,0,0,0|3,0,0]=4 738 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,1,0,0,0,0|2,0,0]=3 739 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,1,0,0,0,0|3,0,0]=4 740 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,1,0,0,0,0|3,0,0]=4 741 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,1,0,0,0,0|3,0,0]=4 742 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,1,0,0,0,0|3,0,0]=4 743 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,1,0,0,0,0|1,0,0]=2 744 B7R0.3 CCNCC(=O)NC MCULE-6292959559 [0,1,0,0,0,0|2,0,0]=3 745 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,1,0,0,0,0|1,0,0]=2 746 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,1,0,0,0,0|1,0,0]=2 747 B7R0.3 CCNCC(C)OC MCULE-9115511555 [0,1,0,0,0,0|2,0,1]=4 748 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,1,0,0,0,0|2,1,0]=4 749 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,1,0,0,0,0|2,1,0]=4 750 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,1,0,0,0,0|2,1,0]=4 751 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,1,0,0,0,0|0,1,0]=2 752 B7R0.3 CCSCC(=O)NN MCULE-2532030709 [0,1,0,0,0,0|2,0,0]=3 753 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,1,0,0,0,0|0,0,0]=1 754 B7R0.3 CCSCC(C)NC MCULE-6245105657 [0,1,0,0,0,0|2,0,1]=4 755 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [0,1,0,0,0,0|2,0,1]=4 756 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [0,1,0,0,0,0|2,0,1]=4 757 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [0,1,0,0,0,0|2,0,0]=3 758 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [0,1,0,0,0,0|2,0,0]=3 759 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [0,1,0,0,0,0|2,0,0]=3 760 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,1,0,0,0,0|2,0,0]=3 761 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,1,0,0,0,0|1,1,0]=3 762 B7R0.3 CNC(=O)CN=N#N MCULE-3027813188 [0,1,0,0,0,0|3,0,0]=4 763 B7R0.3 CNC(=O)NCCN MCULE-4075769099 [0,1,0,0,0,0|3,0,0]=4 764 B7R0.3 CNC(=O)NCCN MCULE-9668937902 [0,1,0,0,0,0|3,0,0]=4 765 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,1,0,0,0,0|3,0,0]=4 766 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,1,0,0,0,0|3,0,0]=4 767 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,1,0,0,0,0|3,0,0]=4 768 B7R0.3 CNC(C)CCSC MCULE-2095620023 [0,1,0,0,0,0|2,0,1]=4 769 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,1,0,0,0,0|2,0,0]=3 770 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,1,0,0,0,0|2,0,0]=3 771 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,1,0,0,0,0|1,0,0]=2 772 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,1,0,0,0,0|1,0,0]=2 773 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,1,0,0,0,0|0,1,0]=2 774 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,1,0,0,0,0|0,1,0]=2 775 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,1,0,0,0,0|0,1,1]=3 776 B7R0.3 COC(=N)CCCCl MCULE-3704020642 [0,1,0,0,0,0|2,0,0]=3 777 B7R0.3 COC(=N)CCCCl MCULE-6282500757 [0,1,0,0,0,0|2,0,0]=3 778 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [0,1,0,0,0,0|1,0,1]=3 779 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [0,1,0,0,0,0|1,0,1]=3 780 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [0,1,0,0,0,0|1,0,1]=3 781 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [0,1,0,0,0,0|1,0,1]=3 782 B7R0.3 COC(=O)C#CCN MCULE-5567960811 [0,1,0,0,0,0|1,0,1]=3 783 B7R0.3 COC(=O)C#CCN MCULE-9518684465 [0,1,0,0,0,0|1,0,1]=3 784 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,1,0,0,0,0|1,0,1]=3 785 B7R0.3 COC(=O)C=CC=O MCULE-3663456611 [0,1,0,0,0,0|1,0,2]=4 786 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [0,1,0,0,0,0|1,0,1]=3 787 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [0,1,0,0,0,0|1,0,1]=3 788 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [0,1,0,0,0,0|1,0,1]=3 789 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [0,1,0,0,0,0|1,0,1]=3 790 B7R0.3 COC(=O)CCC#N MCULE-3476013569 [0,1,0,0,0,0|1,0,1]=3 791 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,1,0,0,0,0|1,0,1]=3 792 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,1,0,0,0,0|1,0,0]=2 793 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,1,0,0,0,0|1,0,0]=2 794 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,1,0,0,0,0|1,0,0]=2 795 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,1,0,0,0,0|1,0,0]=2 796 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,1,0,0,0,0|1,0,0]=2 797 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,1,0,0,0,0|1,0,0]=2 798 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,1,0,0,0,0|1,0,0]=2 799 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,1,0,0,0,0|0,0,0]=1 800 B7R0.3 COC(=O)CN=C=O MCULE-4495056254 [0,1,0,0,0,0|1,0,1]=3 801 B7R0.3 COC(=O)CN=C=S MCULE-6944178765 [0,1,0,0,0,0|1,0,1]=3 802 B7R0.3 COC(=O)CN=N#N MCULE-8257278223 [0,1,0,0,0,0|2,0,0]=3 803 B7R0.3 COC(=O)CNC=O MCULE-1485317532 [0,1,0,0,0,0|1,0,1]=3 804 B7R0.3 COC(=O)NCCN MCULE-4816806580 [0,1,0,0,0,0|2,0,0]=3 805 B7R0.3 COC(=O)NCCN MCULE-9765640123 [0,1,0,0,0,0|2,0,0]=3 806 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,1,0,0,0,0|2,0,0]=3 807 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,1,0,0,0,0|0,1,1]=3 808 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,1,0,0,0,0|2,1,0]=4 809 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,1,0,0,0,0|2,1,0]=4 810 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,1,0,0,0,0|0,1,0]=2 811 B7R0.3 NNC(=O)CCCCl MCULE-9370062145 [0,1,0,0,0,0|3,0,0]=4 812 B7R0.3 NNC(=O)CCCO MCULE-4131007358 [0,1,0,0,0,0|3,0,0]=4 813 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,1,0,0,0,0|3,0,0]=4 814 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [0,1,0,0,0,0|3,0,0]=4 815 B7R0.5 CC(C)C(=O)CC#N MCULE-1573579728 [0,1,0,0,0,0|3,0,0]=4 816 B7R0.5 CC(C)C(=O)CCN MCULE-1638964690 [0,1,0,0,0,0|3,0,0]=4 817 B7R0.5 CC(C)C(=O)CCN MCULE-5188027669 [0,1,0,0,0,0|3,0,0]=4 818 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,1,0,0,0,0|2,0,0]=3 819 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,1,0,0,0,0|3,0,0]=4 820 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,1,0,0,0,0|3,0,0]=4 821 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,1,0,0,0,0|2,0,0]=3 822 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,1,0,0,0,0|2,0,0]=3 823 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [0,1,0,0,0,0|2,0,0]=3 824 B7R0.5 CCNC(=O)C(C)Br MCULE-4342500989 [0,1,0,0,0,0|3,0,0]=4 825 B7R0.5 CCNC(=O)C(C)Cl MCULE-2094375104 [0,1,0,0,0,0|3,0,0]=4 826 B7R0.5 CCNC(=O)C(C)N MCULE-7767946644 [0,1,0,0,0,0|3,0,0]=4 827 B7R0.5 CCNC(=O)C(C)N MCULE-8324775088 [0,1,0,0,0,0|3,0,0]=4 828 B7R0.5 CCNC(=O)C(C)N MCULE-9028977052 [0,1,0,0,0,0|3,0,0]=4 829 B7R0.5 CCNC(=O)N(C)N MCULE-4378383472 [0,1,0,0,0,0|3,0,0]=4 830 B7R0.5 CCNC(=O)[C@H](C)N MCULE-1043080386 [0,1,0,0,0,0|3,0,0]=4 831 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,1,0,0,0,0|3,0,0]=4 832 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,1,0,0,0,0|3,0,0]=4 833 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,1,0,0,0,0|3,0,0]=4 834 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,1,0,0,0,0|3,0,0]=4 835 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,1,0,0,0,0|3,0,0]=4 836 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,1,0,0,0,0|3,0,0]=4 837 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,1,0,0,0,0|3,0,0]=4 838 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,1,0,0,0,0|3,0,0]=4 839 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,1,0,0,0,0|3,0,0]=4 840 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,1,0,0,0,0|3,0,0]=4 841 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,1,0,0,0,0|3,0,0]=4 842 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,1,0,0,0,0|3,0,0]=4 843 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,1,0,0,0,0|3,0,0]=4 844 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,1,0,0,0,0|3,0,0]=4 845 B7R0.5 CCOC(=O)N(C)C MCULE-8344568471 [0,1,0,0,0,0|3,0,0]=4 846 B7R0.5 CCOC(=O)N(C)N MCULE-3043289486 [0,1,0,0,0,0|3,0,0]=4 847 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,1,0,0,0,0|3,0,0]=4 848 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,1,0,0,0,0|3,0,0]=4 849 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,1,0,0,0,0|3,0,0]=4 850 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,1,0,0,0,0|3,0,0]=4 851 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,1,0,0,0,0|3,0,0]=4 852 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,1,0,0,0,0|3,0,0]=4 853 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,1,0,0,0,0|3,0,0]=4 854 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,1,0,0,0,0|3,0,0]=4 855 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,1,0,0,0,0|3,0,0]=4 856 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,1,0,0,0,0|3,0,0]=4 857 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,1,0,0,0,0|3,0,0]=4 858 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,1,0,0,0,0|3,0,0]=4 859 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,1,0,0,0,0|3,0,0]=4 860 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,1,0,0,0,0|3,0,0]=4 861 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,1,0,0,0,0|3,0,0]=4 862 B7R0.5 CCSC(=O)C(C)N MCULE-3205133332 [0,1,0,0,0,0|3,0,0]=4 863 B7R0.5 CCSC(=O)C(C)N MCULE-4228316337 [0,1,0,0,0,0|3,0,0]=4 864 B7R0.5 CCSC(=O)[C@H](C)N MCULE-3136283874 [0,1,0,0,0,0|3,0,0]=4 865 B7R0.5 CCSC(=O)[C@H](C)N MCULE-7218618193 [0,1,0,0,0,0|3,0,0]=4 866 B7R0.5 CCSC(=O)[C@H](C)N MCULE-8421179745 [0,1,0,0,0,0|3,0,0]=4 867 B7R0.5 CCSC(=O)[C@H](C)N MCULE-9872171069 [0,1,0,0,0,0|3,0,0]=4 868 B7R0.5 CN(C)C(=O)CC#N MCULE-2778522530 [0,1,0,0,0,0|3,0,0]=4 869 B7R0.5 CN(C)C(=O)CCBr MCULE-5913033830 [0,1,0,0,0,0|3,0,0]=4 870 B7R0.5 CN(C)C(=O)CCCl MCULE-3291912562 [0,1,0,0,0,0|3,0,0]=4 871 B7R0.5 CN(C)C(=O)CCN MCULE-1852673058 [0,1,0,0,0,0|3,0,0]=4 872 B7R0.5 CN(C)C(=O)CCN MCULE-6281328637 [0,1,0,0,0,0|3,0,0]=4 873 B7R0.5 CN(C)C(=O)CCO MCULE-8849440937 [0,1,0,0,0,0|3,0,0]=4 874 B7R0.5 CN(C)C(=O)CON MCULE-4400747484 [0,1,0,0,0,0|2,1,0]=4 875 B7R0.5 CNCC(=O)N(C)C MCULE-2332172341 [0,1,0,0,0,0|2,0,0]=3 876 B7R0.5 CNCC(=O)N(C)C MCULE-6934800093 [0,1,0,0,0,0|2,0,0]=3 877 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,1,0,0,0,0|1,1,0]=3 878 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,1,0,0,0,0|1,1,0]=3 879 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,1,0,0,0,0|1,0,1]=3 880 B7R0.7 C/C=C/C(=O)OCC MCULE-8433823264 [0,1,0,0,0,0|1,0,1]=3 881 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [0,1,0,0,0,0|3,0,0]=4 882 B7R0.7 C=C(OCC)OCC MCULE-5191107236 [0,1,0,0,0,0|3,0,0]=4 883 B7R0.7 C=C=CC(=O)OCC MCULE-9108726418 [0,1,0,0,0,0|1,0,2]=4 884 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,1,0,0,0,0|1,0,1]=3 885 B7R0.7 C=COC(=O)/C=C/C MCULE-3646996165 [0,1,0,0,0,0|1,0,2]=4 886 B7R0.7 C=COC(=O)C=CC MCULE-7917602280 [0,1,0,0,0,0|1,0,2]=4 887 B7R0.7 C=COC(=O)CCC MCULE-2764567967 [0,1,0,0,0,0|1,0,1]=3 888 B7R0.7 CC#CC(=O)OCC MCULE-3358315498 [0,1,0,0,0,0|1,0,1]=3 889 B7R0.7 CC=CC(=O)OCC MCULE-1904771513 [0,1,0,0,0,0|1,0,1]=3 890 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [0,1,0,0,0,0|2,0,0]=3 891 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [0,1,0,0,0,0|2,0,0]=3 892 B7R0.7 CCCC(=O)CC#N MCULE-7580308812 [0,1,0,0,0,0|2,0,1]=4 893 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,1,0,0,0,0|2,0,0]=3 894 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,1,0,0,0,0|1,0,0]=2 895 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,1,0,0,0,0|1,0,0]=2 896 B7R0.7 CCCC(C)OCC MCULE-2678814077 [0,1,0,0,0,0|2,0,1]=4 897 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [0,1,0,0,0,0|3,0,0]=4 898 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,1,0,0,0,0|3,0,0]=4 899 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,1,0,0,0,0|3,0,0]=4 900 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,1,0,0,0,0|3,0,0]=4 901 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,1,0,0,0,0|3,0,0]=4 902 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [0,1,0,0,0,0|2,0,0]=3 903 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [0,1,0,0,0,0|2,0,0]=3 904 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [0,1,0,0,0,0|3,0,0]=4 905 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,1,0,0,0,0|2,0,0]=3 906 B7R0.7 CCOC(=N)CC#N MCULE-3997647151 [0,1,0,0,0,0|3,0,0]=4 907 B7R0.7 CCOC(=N)CC#N MCULE-6574650764 [0,1,0,0,0,0|3,0,0]=4 908 B7R0.7 CCOC(=N)CCCl MCULE-3462649487 [0,1,0,0,0,0|3,0,0]=4 909 B7R0.7 CCOC(=N)CCCl MCULE-7130199135 [0,1,0,0,0,0|3,0,0]=4 910 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [0,1,0,0,0,0|3,0,0]=4 911 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [0,1,0,0,0,0|3,0,0]=4 912 B7R0.7 CCOC(=N)COC MCULE-1358920023 [0,1,0,0,0,0|1,1,0]=3 913 B7R0.7 CCOC(=N)COC MCULE-8494947544 [0,1,0,0,0,0|1,1,0]=3 914 B7R0.7 CCOC(=O)/C=C/I MCULE-4105665503 [0,1,0,0,0,0|2,0,1]=4 915 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,1,0,0,0,0|2,0,1]=4 916 B7R0.7 CCOC(=O)/C=C/[O-] MCULE-5625833261 [0,1,0,0,0,0|2,0,1]=4 917 B7R0.7 CCOC(=O)/C=C\Br MCULE-7525620721 [0,1,0,0,0,0|2,0,1]=4 918 B7R0.7 CCOC(=O)/C=C\I MCULE-4741067503 [0,1,0,0,0,0|2,0,1]=4 919 B7R0.7 CCOC(=O)/C=C\N MCULE-1135242139 [0,1,0,0,0,0|2,0,1]=4 920 B7R0.7 CCOC(=O)C#CBr MCULE-5306962165 [0,1,0,0,0,0|2,0,1]=4 921 B7R0.7 CCOC(=O)C=CBr MCULE-3778834856 [0,1,0,0,0,0|2,0,1]=4 922 B7R0.7 CCOC(=O)C=CI MCULE-9930784067 [0,1,0,0,0,0|2,0,1]=4 923 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,1,0,0,0,0|2,0,1]=4 924 B7R0.7 CCOC(=O)C=C[O-] MCULE-8425740727 [0,1,0,0,0,0|2,0,1]=4 925 B7R0.7 CCOC(=O)C=NN MCULE-5132323904 [0,1,0,0,0,0|2,0,1]=4 926 B7R0.7 CCOC(=O)C=NN MCULE-5899717314 [0,1,0,0,0,0|2,0,1]=4 927 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,1,0,0,0,0|2,0,1]=4 928 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,1,0,0,0,0|2,0,0]=3 929 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,1,0,0,0,0|2,0,0]=3 930 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,1,0,0,0,0|2,0,0]=3 931 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,1,0,0,0,0|2,0,0]=3 932 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,1,0,0,0,0|2,0,0]=3 933 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,1,0,0,0,0|2,0,0]=3 934 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,1,0,0,0,0|2,0,0]=3 935 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,1,0,0,0,0|2,0,0]=3 936 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,1,0,0,0,0|2,0,0]=3 937 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,1,0,0,0,0|1,0,0]=2 938 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,1,0,0,0,0|1,0,0]=2 939 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,1,0,0,0,0|2,0,0]=3 940 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,1,0,0,0,0|2,0,0]=3 941 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,1,0,0,0,0|2,0,0]=3 942 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,1,0,0,0,0|0,1,0]=2 943 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,1,0,0,0,0|1,1,0]=3 944 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,1,0,0,0,0|0,0,0]=1 945 B7R0.7 CCOC(=O)N=C=O MCULE-6030513409 [0,1,0,0,0,0|3,0,0]=4 946 B7R0.7 CCOC(=O)N=C=S MCULE-1259119752 [0,1,0,0,0,0|3,0,0]=4 947 B7R0.7 CCOC(=O)N=S=O MCULE-2418866175 [0,1,0,0,0,0|2,0,1]=4 948 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,1,0,0,0,0|3,0,0]=4 949 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,1,0,0,0,0|3,0,0]=4 950 B7R0.7 CCOC(=O)NNC MCULE-8689837834 [0,1,0,0,0,0|2,0,0]=3 951 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,1,0,0,0,0|1,1,0]=3 952 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,1,0,0,0,0|2,0,0]=3 953 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,1,0,0,0,0|2,0,0]=3 954 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,1,0,0,0,0|2,0,0]=3 955 B7R0.7 CCOC(=O)[CH-]C=O MCULE-1944484299 [0,1,0,0,0,0|2,0,1]=4 956 B7R0.7 CCOC(=O)[CH-]C=O MCULE-5022028224 [0,1,0,0,0,0|2,0,1]=4 957 B7R0.7 CCOC(=S)SCC MCULE-9637505732 [0,1,0,0,0,0|2,1,0]=4 958 B7R0.7 CCOC(C)CNC MCULE-9630095723 [0,1,0,0,0,0|2,0,1]=4 959 B7R0.7 CCOS(=O)OCC MCULE-6252684995 [0,1,0,0,0,0|3,0,0]=4 960 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [0,1,0,0,0,0|2,1,0]=4 961 B7R0.7 CNCC(O)COC MCULE-8497493216 [0,1,0,0,0,0|1,0,2]=4 962 B7R0.7 COCC(=CCBr)C MCULE-6258296852 [0,1,0,0,0,0|2,1,0]=4 963 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,1,0,0,0,0|2,0,0]=3 964 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,1,0,0,0,0|0,1,0]=2 965 B7R0.7 COCC(Br)COC MCULE-8590528928 [0,1,0,0,0,0|1,1,1]=4 966 B7R0.7 COCC(Cl)COC MCULE-1871071718 [0,1,0,0,0,0|1,1,1]=4 967 B7R0.7 COCC(N)COC MCULE-3531117264 [0,1,0,0,0,0|1,1,1]=4 968 B7R0.7 COCC(N)COC MCULE-3609597955 [0,1,0,0,0,0|1,1,1]=4 969 B7R0.7 COCC(O)COC MCULE-5364514636 [0,1,0,0,0,0|0,1,2]=4 970 B7R0.7 CSCC(N)CCO MCULE-2899374338 [0,1,0,0,0,0|2,0,1]=4 971 B7R0.7 O=C(CCBr)CCBr MCULE-4794296091 [0,1,0,0,0,0|3,0,0]=4 972 B7R0.7 O=C(CCCl)CCCl MCULE-1408529874 [0,1,0,0,0,0|3,0,0]=4 973 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [0,1,0,0,0,0|3,0,0]=4 974 B7R0.7 P(=O)(OCC)OCC MCULE-8519301551 [0,1,0,0,0,0|3,0,0]=4 975 B7R0.10 C/C=C(/C)\C(=O)OC MCULE-6490619453 [0,1,0,0,0,0|1,0,1]=3 976 B7R0.10 C/C=C(\C)/C(=O)OC MCULE-2521624465 [0,1,0,0,0,0|1,0,1]=3 977 B7R0.10 C=C(C#N)C(=O)OC MCULE-4928080553 [0,1,0,0,0,0|2,0,1]=4 978 B7R0.10 C=C(CBr)C(=O)OC MCULE-7991860093 [0,1,0,0,0,0|2,0,1]=4 979 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [0,1,0,0,0,0|1,0,1]=3 980 B7R0.10 C=C(CCl)C(=O)OC MCULE-8356509776 [0,1,0,0,0,0|2,0,1]=4 981 B7R0.10 C=C(CO)C(=O)OC MCULE-8888105984 [0,1,0,0,0,0|2,0,1]=4 982 B7R0.10 C=C(OC)C(=O)OC MCULE-3256769494 [0,1,0,0,0,0|0,1,1]=3 983 B7R0.10 C=CC(Cl)C(=O)OC MCULE-8371197919 [0,1,0,0,0,0|1,0,1]=3 984 B7R0.10 C=CC(N)C(=O)OC MCULE-6449924585 [0,1,0,0,0,0|1,0,1]=3 985 B7R0.10 C=CC(N)C(=O)OC MCULE-8138684326 [0,1,0,0,0,0|1,0,1]=3 986 B7R0.10 C=CC(O)C(=O)OC MCULE-8475572887 [0,1,0,0,0,0|1,0,1]=3 987 B7R0.10 CC=C(Br)C(=O)OC MCULE-8210439839 [0,1,0,0,0,0|1,0,1]=3 988 B7R0.10 CC=C(C)C(=O)OC MCULE-7431996149 [0,1,0,0,0,0|1,0,1]=3 989 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [0,1,0,0,0,0|2,0,1]=4 990 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [0,1,0,0,0,0|1,0,1]=3 991 B7R0.10 CCC(=O)C(C)C#N MCULE-5937845036 [0,1,0,0,0,0|3,0,0]=4 992 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,1,0,0,0,0|2,0,0]=3 993 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,1,0,0,0,0|3,0,0]=4 994 B7R0.10 CCC(=O)N(C)OC MCULE-7450696534 [0,1,0,0,0,0|2,1,0]=4 995 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [0,1,0,0,0,0|2,0,0]=3 996 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [0,1,0,0,0,0|1,0,0]=2 997 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,1,0,0,0,0|3,0,0]=4 998 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,1,0,0,0,0|3,0,0]=4 999 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [0,1,0,0,0,0|2,0,0]=3 1000 B7R0.10 CCC(C)C(=O)NN MCULE-4144584435 [0,1,0,0,0,0|3,0,0]=4 1001 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,1,0,0,0,0|1,0,0]=2 1002 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [0,1,0,0,0,0|1,0,0]=2 1003 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [0,1,0,0,0,0|2,0,0]=3 1004 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [0,1,0,0,0,0|2,0,0]=3 1005 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,1,0,0,0,0|3,0,0]=4 1006 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,1,0,0,0,0|1,0,0]=2 1007 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,1,0,0,0,0|1,0,0]=2 1008 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,1,0,0,0,0|1,0,0]=2 1009 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,1,0,0,0,0|1,0,0]=2 1010 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,1,0,0,0,0|1,0,0]=2 1011 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [0,1,0,0,0,0|1,0,0]=2 1012 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,1,0,0,0,0|1,0,0]=2 1013 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,1,0,0,0,0|1,0,0]=2 1014 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,1,0,0,0,0|1,0,0]=2 1015 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,1,0,0,0,0|1,0,0]=2 1016 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,1,0,0,0,0|1,0,0]=2 1017 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,1,0,0,0,0|1,0,0]=2 1018 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [0,1,0,0,0,0|1,0,0]=2 1019 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,1,0,0,0,0|1,0,0]=2 1020 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,1,0,0,0,0|1,0,0]=2 1021 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,1,0,0,0,0|1,0,0]=2 1022 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,1,0,0,0,0|1,0,0]=2 1023 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,1,0,0,0,0|1,0,0]=2 1024 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,1,0,0,0,0|1,0,0]=2 1025 B7R0.10 CNC(=O)C(=O)NC MCULE-5993874240 [0,1,0,0,0,0|2,0,1]=4 1026 B7R0.10 CNC(=O)C(=O)OC MCULE-1771479923 [0,1,0,0,0,0|1,0,1]=3 1027 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [0,1,0,0,0,0|3,0,0]=4 1028 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [0,1,0,0,0,0|3,0,0]=4 1029 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [0,1,0,0,0,0|2,0,0]=3 1030 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,1,0,0,0,0|3,0,0]=4 1031 B7R0.10 CNC(=O)C(O)CN MCULE-4650373222 [0,1,0,0,0,0|3,0,0]=4 1032 B7R0.10 CNC(=O)C(O)CN MCULE-8978952332 [0,1,0,0,0,0|3,0,0]=4 1033 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [0,1,0,0,0,0|2,0,0]=3 1034 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [0,1,0,0,0,0|2,0,0]=3 1035 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [0,1,0,0,0,0|1,0,0]=2 1036 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [0,1,0,0,0,0|1,0,0]=2 1037 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [0,1,0,0,0,0|1,0,0]=2 1038 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [0,1,0,0,0,0|1,0,0]=2 1039 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [0,1,0,0,0,0|1,0,0]=2 1040 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [0,1,0,0,0,0|1,0,0]=2 1041 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [0,1,0,0,0,0|1,0,0]=2 1042 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [0,1,0,0,0,0|1,0,0]=2 1043 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [0,1,0,0,0,0|1,0,0]=2 1044 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [0,1,0,0,0,0|1,0,0]=2 1045 B7R0.10 COC(=O)/C(=C/Br)/C MCULE-9213242172 [0,1,0,0,0,0|2,0,1]=4 1046 B7R0.10 COC(=O)/C(=C/Cl)/Cl MCULE-7181141754 [0,1,0,0,0,0|2,0,1]=4 1047 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-5795286951 [0,1,0,0,0,0|2,0,1]=4 1048 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-6102470934 [0,1,0,0,0,0|2,0,1]=4 1049 B7R0.10 COC(=O)/C(=N/O)/N MCULE-6279341489 [0,1,0,0,0,0|2,0,1]=4 1050 B7R0.10 COC(=O)C(=CBr)C MCULE-2452279572 [0,1,0,0,0,0|2,0,1]=4 1051 B7R0.10 COC(=O)C(=O)CBr MCULE-7596502094 [0,1,0,0,0,0|2,0,1]=4 1052 B7R0.10 COC(=O)C(=O)NN MCULE-7834741474 [0,1,0,0,0,0|2,0,1]=4 1053 B7R0.10 COC(=O)C(=O)OC MCULE-5018268642 [0,1,0,0,0,0|0,1,1]=3 1054 B7R0.10 COC(=O)C(Br)CBr MCULE-7056048789 [0,1,0,0,0,0|2,0,0]=3 1055 B7R0.10 COC(=O)C(Br)CF MCULE-4013908914 [0,1,0,0,0,0|2,0,0]=3 1056 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,1,0,0,0,0|2,0,0]=3 1057 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,1,0,0,0,0|2,0,0]=3 1058 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,1,0,0,0,0|0,1,0]=2 1059 B7R0.10 COC(=O)C(C)C#N MCULE-3764857061 [0,1,0,0,0,0|2,0,0]=3 1060 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [0,1,0,0,0,0|2,0,0]=3 1061 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [0,1,0,0,0,0|2,0,0]=3 1062 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [0,1,0,0,0,0|2,0,0]=3 1063 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [0,1,0,0,0,0|2,0,0]=3 1064 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [0,1,0,0,0,0|2,0,0]=3 1065 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,1,0,0,0,0|2,0,0]=3 1066 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,1,0,0,0,0|2,0,0]=3 1067 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [0,1,0,0,0,0|2,0,0]=3 1068 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,1,0,0,0,0|0,1,0]=2 1069 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [0,1,0,0,0,0|1,1,0]=3 1070 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [0,1,0,0,0,0|1,1,0]=3 1071 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,1,0,0,0,0|0,0,0]=1 1072 B7R0.10 COC(=O)C(Cl)C=O MCULE-1767241035 [0,1,0,0,0,0|2,0,0]=3 1073 B7R0.10 COC(=O)C(Cl)CCl MCULE-3086208783 [0,1,0,0,0,0|2,0,0]=3 1074 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,1,0,0,0,0|2,0,0]=3 1075 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,1,0,0,0,0|0,1,0]=2 1076 B7R0.10 COC(=O)C(F)CN MCULE-3089053107 [0,1,0,0,0,0|2,0,0]=3 1077 B7R0.10 COC(=O)C(F)CN MCULE-5618581260 [0,1,0,0,0,0|2,0,0]=3 1078 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,1,0,0,0,0|2,0,0]=3 1079 B7R0.10 COC(=O)C(N)C#N MCULE-9016686741 [0,1,0,0,0,0|2,0,0]=3 1080 B7R0.10 COC(=O)C(N)CCl MCULE-2253564316 [0,1,0,0,0,0|2,0,0]=3 1081 B7R0.10 COC(=O)C(N)CCl MCULE-3851909822 [0,1,0,0,0,0|2,0,0]=3 1082 B7R0.10 COC(=O)C(N)CCl MCULE-4649966066 [0,1,0,0,0,0|2,0,0]=3 1083 B7R0.10 COC(=O)C(N)CCl MCULE-9193407415 [0,1,0,0,0,0|2,0,0]=3 1084 B7R0.10 COC(=O)C(N)CF MCULE-2617218019 [0,1,0,0,0,0|2,0,0]=3 1085 B7R0.10 COC(=O)C(N)CF MCULE-3926207531 [0,1,0,0,0,0|2,0,0]=3 1086 B7R0.10 COC(=O)C(N)CN MCULE-7949926265 [0,1,0,0,0,0|2,0,0]=3 1087 B7R0.10 COC(=O)C(N)CN MCULE-9215212479 [0,1,0,0,0,0|2,0,0]=3 1088 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,1,0,0,0,0|2,0,0]=3 1089 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,1,0,0,0,0|2,0,0]=3 1090 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,1,0,0,0,0|2,0,0]=3 1091 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,1,0,0,0,0|2,0,0]=3 1092 B7R0.10 COC(=O)C(N)CS MCULE-5131519605 [0,1,0,0,0,0|2,0,0]=3 1093 B7R0.10 COC(=O)C(N)CS MCULE-5561205392 [0,1,0,0,0,0|2,0,0]=3 1094 B7R0.10 COC(=O)C(N)CS MCULE-9291008448 [0,1,0,0,0,0|2,0,0]=3 1095 B7R0.10 COC(=O)C(N)CS MCULE-9963292576 [0,1,0,0,0,0|2,0,0]=3 1096 B7R0.10 COC(=O)C(O)C#N MCULE-2296440580 [0,1,0,0,0,0|2,0,0]=3 1097 B7R0.10 COC(=O)C(O)CCl MCULE-1480405341 [0,1,0,0,0,0|2,0,0]=3 1098 B7R0.10 COC(=O)C(O)CN MCULE-1003241246 [0,1,0,0,0,0|2,0,0]=3 1099 B7R0.10 COC(=O)C(O)CN MCULE-9006804473 [0,1,0,0,0,0|2,0,0]=3 1100 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,1,0,0,0,0|2,0,0]=3 1101 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,1,0,0,0,0|2,0,0]=3 1102 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,1,0,0,0,0|0,1,0]=2 1103 B7R0.10 COC(=O)N(C)CCl MCULE-8717315487 [0,1,0,0,0,0|3,0,0]=4 1104 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,1,0,0,0,0|2,0,0]=3 1105 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,1,0,0,0,0|2,0,0]=3 1106 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [0,1,0,0,0,0|2,0,0]=3 1107 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [0,1,0,0,0,0|2,0,0]=3 1108 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [0,1,0,0,0,0|2,0,0]=3 1109 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [0,1,0,0,0,0|2,0,0]=3 1110 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,1,0,0,0,0|2,0,0]=3 1111 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,1,0,0,0,0|2,0,0]=3 1112 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2209395189 [0,1,0,0,0,0|2,0,0]=3 1113 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2951378763 [0,1,0,0,0,0|2,0,0]=3 1114 B7R0.10 COC(=O)[C@@H](F)CN MCULE-4599856185 [0,1,0,0,0,0|2,0,0]=3 1115 B7R0.10 COC(=O)[C@@H](F)CN MCULE-5571914049 [0,1,0,0,0,0|2,0,0]=3 1116 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-1649684135 [0,1,0,0,0,0|2,0,0]=3 1117 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-4803192908 [0,1,0,0,0,0|2,0,0]=3 1118 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-6514033613 [0,1,0,0,0,0|2,0,0]=3 1119 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-7997387565 [0,1,0,0,0,0|2,0,0]=3 1120 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4407014418 [0,1,0,0,0,0|2,0,0]=3 1121 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4854066134 [0,1,0,0,0,0|2,0,0]=3 1122 B7R0.10 COC(=O)[C@@H](N)CN MCULE-5060962890 [0,1,0,0,0,0|2,0,0]=3 1123 B7R0.10 COC(=O)[C@@H](N)CN MCULE-8572432694 [0,1,0,0,0,0|2,0,0]=3 1124 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,1,0,0,0,0|2,0,0]=3 1125 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,1,0,0,0,0|2,0,0]=3 1126 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,1,0,0,0,0|2,0,0]=3 1127 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,1,0,0,0,0|2,0,0]=3 1128 B7R0.10 COC(=O)[C@@H](N)CS MCULE-2560943261 [0,1,0,0,0,0|2,0,0]=3 1129 B7R0.10 COC(=O)[C@@H](N)CS MCULE-3682774490 [0,1,0,0,0,0|2,0,0]=3 1130 B7R0.10 COC(=O)[C@@H](N)CS MCULE-6613123984 [0,1,0,0,0,0|2,0,0]=3 1131 B7R0.10 COC(=O)[C@@H](N)CS MCULE-7354291938 [0,1,0,0,0,0|2,0,0]=3 1132 B7R0.10 COC(=O)[C@@H](O)CN MCULE-1265508864 [0,1,0,0,0,0|2,0,0]=3 1133 B7R0.10 COC(=O)[C@@H](O)CN MCULE-2334791448 [0,1,0,0,0,0|2,0,0]=3 1134 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6207278824 [0,1,0,0,0,0|2,0,0]=3 1135 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6634004594 [0,1,0,0,0,0|2,0,0]=3 1136 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,1,0,0,0,0|2,0,0]=3 1137 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,1,0,0,0,0|2,0,0]=3 1138 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,1,0,0,0,0|2,0,0]=3 1139 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [0,1,0,0,0,0|2,0,0]=3 1140 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [0,1,0,0,0,0|2,0,0]=3 1141 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [0,1,0,0,0,0|2,0,0]=3 1142 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [0,1,0,0,0,0|2,0,0]=3 1143 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [0,1,0,0,0,0|2,0,0]=3 1144 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,1,0,0,0,0|2,0,0]=3 1145 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,1,0,0,0,0|2,0,0]=3 1146 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,1,0,0,0,0|0,1,0]=2 1147 B7R0.10 COC(=O)[C@H](N)CCl MCULE-1199425954 [0,1,0,0,0,0|2,0,0]=3 1148 B7R0.10 COC(=O)[C@H](N)CCl MCULE-2611523756 [0,1,0,0,0,0|2,0,0]=3 1149 B7R0.10 COC(=O)[C@H](N)CCl MCULE-6503487325 [0,1,0,0,0,0|2,0,0]=3 1150 B7R0.10 COC(=O)[C@H](N)CCl MCULE-8714444412 [0,1,0,0,0,0|2,0,0]=3 1151 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,1,0,0,0,0|2,0,0]=3 1152 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,1,0,0,0,0|2,0,0]=3 1153 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,1,0,0,0,0|2,0,0]=3 1154 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,1,0,0,0,0|2,0,0]=3 1155 B7R0.10 COC(=O)[C@H](N)CS MCULE-1845308816 [0,1,0,0,0,0|2,0,0]=3 1156 B7R0.10 COC(=O)[C@H](N)CS MCULE-3480554390 [0,1,0,0,0,0|2,0,0]=3 1157 B7R0.10 COC(=O)[C@H](N)CS MCULE-4432617084 [0,1,0,0,0,0|2,0,0]=3 1158 B7R0.10 COC(=O)[C@H](N)CS MCULE-5747217193 [0,1,0,0,0,0|2,0,0]=3 1159 B7R0.10 COC(=O)[C@H](O)CN MCULE-5902729244 [0,1,0,0,0,0|2,0,0]=3 1160 B7R0.10 COC(=O)[C@H](O)CN MCULE-9252373981 [0,1,0,0,0,0|2,0,0]=3 1161 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,1,0,0,0,0|2,0,0]=3 1162 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,1,0,0,0,0|2,0,0]=3 1163 B7R0.10 COC(C)C(=O)NN MCULE-7263059210 [0,1,0,0,0,0|2,1,0]=4 1164 B7R0.10 COC(Cl)C(Cl)OC MCULE-4404338670 [0,1,0,0,0,0|1,1,1]=4 1165 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [0,1,0,0,0,0|1,0,0]=2 1166 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [0,1,0,0,0,0|1,0,0]=2 1167 B7R0.11 CCC[Si](C)(C)OC MCULE-9871586607 [0,1,0,0,0,0|2,1,0]=4 1168 B7R0.12 CCC(CSC)NC MCULE-6079897043 [0,1,0,0,0,0|2,0,1]=4 1169 B7R0.12 CCCC(C#N)OC MCULE-8004262029 [0,1,0,0,0,0|2,0,1]=4 1170 B7R0.12 CCCC(CN)OC MCULE-6456891707 [0,1,0,0,0,0|2,0,1]=4 1171 B7R0.12 CCCC(CO)OC MCULE-9427398002 [0,1,0,0,0,0|1,0,2]=4 1172 B7R0.12 CCCC(OC)OC MCULE-9755419351 [0,1,0,0,0,0|1,0,2]=4 1173 B7R0.12 CNCC(OC)OC MCULE-4492281270 [0,1,0,0,0,0|1,0,2]=4 1174 B7R0.12 COC(CSC)OC MCULE-7367035915 [0,1,0,0,0,0|0,0,2]=3 1175 B7R0.12 COCC(C#N)OC MCULE-4608647789 [0,1,0,0,0,0|1,1,1]=4 1176 B7R0.12 COCC(CBr)OC MCULE-9551672317 [0,1,0,0,0,0|1,1,1]=4 1177 B7R0.12 COCC(CN)OC MCULE-4660699329 [0,1,0,0,0,0|1,1,1]=4 1178 B7R0.12 COCC(CO)OC MCULE-6775038884 [0,1,0,0,0,0|0,1,2]=4 1179 B7R0.12 COCC(OC)OC MCULE-1839791643 [0,1,0,0,0,0|0,1,2]=4 1180 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [0,1,0,0,0,0|0,1,2]=4 1181 B7R0.12 COC[C@H](CN)OC MCULE-7911151873 [0,1,0,0,0,0|1,1,1]=4 1182 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [0,0,0,1,0,0|2,0,1]=4 1183 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [0,0,0,1,0,0|2,0,1]=4 1184 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [0,0,0,1,0,0|3,0,0]=4 1185 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [0,0,0,1,0,0|3,0,0]=4 1186 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [0,0,0,1,0,0|3,0,0]=4 1187 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,0,0,1,0,0|3,0,0]=4 1188 B7R1.1 CNC1CCSC1 MCULE-1603222229 [0,0,0,1,0,0|2,0,1]=4 1189 B7R1.1 CNC1CCSC1 MCULE-5376977039 [0,0,0,1,0,0|2,0,1]=4 1190 B7R1.1 CNC1CCSC1 MCULE-9789640029 [0,0,0,1,0,0|2,0,1]=4 1191 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,0,0,1,0,0|2,0,0]=3 1192 B7R1.1 COC1=CCCN1 MCULE-6283476666 [0,0,0,1,0,0|2,0,1]=4 1193 B7R1.1 COC1=CSC=C1 MCULE-3476811638 [0,0,0,1,0,0|1,0,2]=4 1194 B7R1.1 COC1=NCCC1 MCULE-2625712954 [0,0,0,1,0,0|2,0,0]=3 1195 B7R1.1 COC1=NCCN1 MCULE-4640802770 [0,0,0,1,0,0|3,0,0]=4 1196 B7R1.1 COC1=NSC=C1 MCULE-5378872433 [0,0,0,1,0,0|2,0,1]=4 1197 B7R1.1 COC1CCCC1 MCULE-7539347010 [0,0,0,1,0,0|2,0,1]=4 1198 B7R1.1 COC1CCCO1 MCULE-8363423240 [0,0,0,1,0,0|1,0,2]=4 1199 B7R1.1 COC1CCNC1 MCULE-1194889067 [0,0,0,1,0,0|2,0,1]=4 1200 B7R1.1 COC1CCNC1 MCULE-2551543855 [0,0,0,1,0,0|2,0,1]=4 1201 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [0,0,0,1,0,0|2,0,1]=4 1202 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [0,0,0,1,0,0|2,0,1]=4 1203 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [0,0,0,1,0,0|2,0,1]=4 1204 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [0,0,0,1,0,0|2,0,1]=4 1205 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [0,0,0,1,0,0|2,0,1]=4 1206 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [0,0,0,1,0,0|2,0,1]=4 1207 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [0,0,0,1,0,0|2,0,1]=4 1208 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [0,0,0,1,0,0|2,0,1]=4 1209 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [0,0,0,1,0,0|3,0,0]=4 1210 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,0,0,1,0,0|3,0,0]=4 1211 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,0,0,1,0,0|3,0,0]=4 1212 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,0,0,1,0,0|3,0,0]=4 1213 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,0,0,1,0,0|2,0,0]=3 1214 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,0,0,1,0,0|2,0,1]=4 1215 B7R1.2 CC1=CC(=O)OC1 MCULE-6549202383 [0,0,0,1,0,0|1,0,1]=3 1216 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,0,0,1,0,0|3,0,0]=4 1217 B7R1.2 CC1=NNC(=O)C1 MCULE-2406140611 [0,0,0,1,0,0|3,0,0]=4 1218 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,0,0,1,0,0|2,0,0]=3 1219 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,0,0,1,0,0|2,0,0]=3 1220 B7R1.2 CC1=NOC(=O)O1 MCULE-5416417255 [0,0,0,1,0,0|3,0,0]=4 1221 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,0,0,1,0,0|3,0,0]=4 1222 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,0,0,1,0,0|3,0,0]=4 1223 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,0,0,1,0,0|3,0,0]=4 1224 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,0,0,1,0,0|3,0,0]=4 1225 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,0,0,1,0,0|2,0,0]=3 1226 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,0,0,1,0,0|3,0,0]=4 1227 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,0,0,1,0,0|3,0,0]=4 1228 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,0,0,1,0,0|3,0,0]=4 1229 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,0,0,1,0,0|2,0,0]=3 1230 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,0,0,1,0,0|3,0,0]=4 1231 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,0,0,1,0,0|3,0,0]=4 1232 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,0,0,1,0,0|1,0,0]=2 1233 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,0,0,1,0,0|2,0,0]=3 1234 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,0,0,1,0,0|2,0,0]=3 1235 B7R1.2 CC1COC(=S)N1 MCULE-4793665300 [0,0,0,1,0,0|2,1,0]=4 1236 B7R1.2 CC1COS(=O)O1 MCULE-7795249539 [0,0,0,1,0,0|3,0,0]=4 1237 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,0,0,1,0,0|2,1,0]=4 1238 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,0,0,1,0,0|2,0,0]=3 1239 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,0,0,1,0,0|2,0,0]=3 1240 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,0,0,1,0,0|3,0,0]=4 1241 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,0,0,1,0,0|3,0,0]=4 1242 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,0,0,1,0,0|3,0,0]=4 1243 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,0,0,1,0,0|3,0,0]=4 1244 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,0,0,1,0,0|3,0,0]=4 1245 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,0,0,1,0,0|2,0,0]=3 1246 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,0,0,1,0,0|2,0,0]=3 1247 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,0,0,1,0,0|3,0,0]=4 1248 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,0,0,1,0,0|3,0,0]=4 1249 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,0,0,1,0,0|1,0,0]=2 1250 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,0,0,1,0,0|1,0,0]=2 1251 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,0,0,1,0,0|2,0,0]=3 1252 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,0,0,1,0,0|2,0,0]=3 1253 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,0,0,1,0,0|2,0,0]=3 1254 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,0,0,1,0,0|2,0,0]=3 1255 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,0,0,1,0,0|3,0,0]=4 1256 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,0,0,1,0,0|3,0,0]=4 1257 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,0,0,1,0,0|3,0,0]=4 1258 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,0,0,1,0,0|3,0,0]=4 1259 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,0,0,1,0,0|2,0,0]=3 1260 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,0,0,1,0,0|3,0,0]=4 1261 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,0,0,1,0,0|3,0,0]=4 1262 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,0,0,1,0,0|3,0,0]=4 1263 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,0,0,1,0,0|2,0,0]=3 1264 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,0,0,1,0,0|2,0,0]=3 1265 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,0,0,1,0,0|1,0,0]=2 1266 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,0,0,1,0,0|2,0,0]=3 1267 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,0,0,1,0,0|2,0,0]=3 1268 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,0,0,1,0,0|2,0,0]=3 1269 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,0,0,1,0,0|2,0,0]=3 1270 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,0,0,1,0,0|3,0,0]=4 1271 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,0,0,1,0,0|3,0,0]=4 1272 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,0,0,1,0,0|3,0,0]=4 1273 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,0,0,1,0,0|3,0,0]=4 1274 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,0,0,1,0,0|3,0,0]=4 1275 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,0,0,1,0,0|3,0,0]=4 1276 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,0,0,1,0,0|2,0,0]=3 1277 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,0,0,1,0,0|2,0,0]=3 1278 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,0,0,1,0,0|2,0,0]=3 1279 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,0,0,1,0,0|2,0,0]=3 1280 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,0,0,1,0,0|3,0,0]=4 1281 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,0,0,1,0,0|3,0,0]=4 1282 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,0,0,1,0,0|3,0,0]=4 1283 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,0,0,1,0,0|3,0,0]=4 1284 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,0,0,1,0,0|2,0,0]=3 1285 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,0,0,1,0,0|2,0,0]=3 1286 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,0,0,1,0,0|2,0,0]=3 1287 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,0,0,1,0,0|2,0,0]=3 1288 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,0,0,1,0,0|3,0,0]=4 1289 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,0,0,1,0,0|3,0,0]=4 1290 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,0,0,1,0,0|3,0,0]=4 1291 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,0,0,1,0,0|3,0,0]=4 1292 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,0,0,1,0,0|3,0,0]=4 1293 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,0,0,1,0,0|3,0,0]=4 1294 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,0,0,1,0,0|2,0,0]=3 1295 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,0,0,1,0,0|2,0,0]=3 1296 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,0,0,1,0,0|2,0,0]=3 1297 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,0,0,1,0,0|2,0,0]=3 1298 B7R1.2 O=C1C=C(CO1)Br MCULE-8883097432 [0,0,0,1,0,0|2,0,1]=4 1299 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,0,0,1,0,0|2,0,1]=4 1300 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,0,0,1,0,0|2,0,1]=4 1301 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,0,0,1,0,0|3,0,0]=4 1302 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,0,0,1,0,0|3,0,0]=4 1303 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,0,0,1,0,0|2,0,0]=3 1304 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,0,0,1,0,0|2,0,0]=3 1305 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,0,0,1,0,0|3,0,0]=4 1306 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,0,0,1,0,0|3,0,0]=4 1307 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,0,0,1,0,0|3,0,0]=4 1308 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,0,0,1,0,0|3,0,0]=4 1309 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,0,0,1,0,0|3,0,0]=4 1310 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,0,0,1,0,0|2,0,0]=3 1311 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,0,0,1,0,0|3,0,0]=4 1312 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,0,0,1,0,0|3,0,0]=4 1313 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,0,0,1,0,0|3,0,0]=4 1314 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,0,0,1,0,0|3,0,0]=4 1315 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,0,0,1,0,0|2,0,0]=3 1316 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,0,0,1,0,0|2,0,0]=3 1317 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,0,0,1,0,0|3,0,0]=4 1318 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,0,0,1,0,0|3,0,0]=4 1319 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,0,0,1,0,0|3,0,0]=4 1320 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,0,0,1,0,0|3,0,0]=4 1321 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,0,0,1,0,0|2,0,0]=3 1322 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,0,0,1,0,0|2,0,0]=3 1323 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,0,0,1,0,0|3,0,0]=4 1324 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,0,0,1,0,0|3,0,0]=4 1325 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,0,0,1,0,0|2,0,0]=3 1326 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,0,0,1,0,0|3,0,0]=4 1327 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,0,0,1,0,0|3,0,0]=4 1328 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,0,0,1,0,0|3,0,0]=4 1329 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,0,0,1,0,0|2,0,1]=4 1330 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,0,0,1,0,0|2,0,1]=4 1331 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,0,0,1,0,0|2,0,1]=4 1332 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,0,0,1,0,0|3,0,0]=4 1333 B7R1.3 C=C1CCCCN1 MCULE-8375354748 [0,0,0,1,0,0|3,0,0]=4 1334 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [0,0,0,1,0,0|3,0,0]=4 1335 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [0,0,0,1,0,0|3,0,0]=4 1336 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,0,0,1,0,0|2,1,0]=4 1337 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,0,0,1,0,0|3,0,0]=4 1338 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,0,0,1,0,0|3,0,0]=4 1339 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,0,0,1,0,0|3,0,0]=4 1340 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,0,0,1,0,0|3,0,0]=4 1341 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,0,0,1,0,0|2,0,1]=4 1342 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,0,0,1,0,0|2,0,1]=4 1343 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,0,0,1,0,0|2,0,1]=4 1344 B7R1.3 CC1CSCCN1 MCULE-2923436126 [0,0,0,1,0,0|2,0,1]=4 1345 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,0,0,1,0,0|3,0,0]=4 1346 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,0,0,1,0,0|3,0,0]=4 1347 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,0,0,1,0,0|2,0,1]=4 1348 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,0,0,1,0,0|2,0,1]=4 1349 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,0,0,1,0,0|2,0,1]=4 1350 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,0,0,1,0,0|2,0,1]=4 1351 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [0,0,0,1,0,0|2,0,1]=4 1352 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,0,0,1,0,0|2,0,1]=4 1353 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,0,0,1,0,0|2,0,1]=4 1354 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,0,0,1,0,0|2,0,1]=4 1355 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,0,0,1,0,0|2,0,1]=4 1356 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [0,0,0,1,0,0|2,0,1]=4 1357 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,0,0,1,0,0|3,0,0]=4 1358 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,0,0,1,0,0|3,0,0]=4 1359 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,0,0,1,0,0|3,0,0]=4 1360 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,0,0,1,0,0|2,0,1]=4 1361 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,0,0,1,0,0|3,0,0]=4 1362 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,0,0,1,0,0|3,0,0]=4 1363 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,0,0,1,0,0|2,0,1]=4 1364 B7R1.3 N=C1NCCCO1 MCULE-4713912893 [0,0,0,1,0,0|3,0,0]=4 1365 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [0,0,0,1,0,0|3,0,0]=4 1366 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [0,0,0,1,0,0|3,0,0]=4 1367 B7R1.3 NC1=NCCCO1 MCULE-1909217779 [0,0,0,1,0,0|3,0,0]=4 1368 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [0,0,0,1,0,0|2,0,0]=3 1369 B7R1.3 NC1CCCSC1 MCULE-5361360271 [0,0,0,1,0,0|2,0,1]=4 1370 B7R1.3 NC1CCCSC1 MCULE-5652416535 [0,0,0,1,0,0|2,0,1]=4 1371 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,0,0,1,0,0|2,0,1]=4 1372 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,0,0,1,0,0|2,0,1]=4 1373 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,0,0,1,0,0|1,0,1]=3 1374 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,0,0,1,0,0|1,1,1]=4 1375 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,0,0,1,0,0|2,0,1]=4 1376 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,0,0,1,0,0|2,0,0]=3 1377 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,0,0,1,0,0|2,0,0]=3 1378 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,0,0,1,0,0|1,0,0]=2 1379 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,0,0,1,0,0|1,1,0]=3 1380 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,0,0,1,0,0|2,0,0]=3 1381 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,0,0,1,0,0|2,0,0]=3 1382 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,0,0,1,0,0|1,1,0]=3 1383 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,0,0,1,0,0|1,0,0]=2 1384 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,0,0,1,0,0|3,0,0]=4 1385 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,0,0,1,0,0|3,0,0]=4 1386 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,0,0,1,0,0|3,0,0]=4 1387 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,0,0,1,0,0|3,0,0]=4 1388 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,0,0,1,0,0|3,0,0]=4 1389 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,0,0,1,0,0|2,0,0]=3 1390 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,0,0,1,0,0|1,0,0]=2 1391 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,0,0,1,0,0|1,0,0]=2 1392 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,0,0,1,0,0|1,1,0]=3 1393 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,0,0,1,0,0|0,1,0]=2 1394 B7R1.3 O=C1CSC=CN1 MCULE-7195428643 [0,0,0,1,0,0|1,0,2]=4 1395 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,0,0,1,0,0|1,0,0]=2 1396 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,0,0,1,0,0|2,0,0]=3 1397 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,0,0,1,0,0|3,0,0]=4 1398 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,0,0,1,0,0|2,0,0]=3 1399 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,0,0,1,0,0|2,0,0]=3 1400 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,0,0,1,0,0|2,0,0]=3 1401 B7R1.3 O=P1OCCCO1 MCULE-9154920312 [0,0,0,1,0,0|3,0,0]=4 1402 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,0,0,1,0,0|3,0,0]=4 1403 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [0,0,0,1,0,0|2,0,0]=3 1404 B7R1.3 O=S1OCCCO1 MCULE-4755606100 [0,0,0,1,0,0|3,0,0]=4 1405 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,0,0,1,0,0|1,0,2]=4 1406 B7R1.3 OC1CCCSC1 MCULE-1448781710 [0,0,0,1,0,0|1,0,2]=4 1407 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,0,0,1,0,0|1,0,2]=4 1408 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,0,0,1,0,0|1,0,2]=4 1409 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,0,0,1,0,0|2,1,0]=4 1410 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [0,0,0,1,0,0|2,1,0]=4 1411 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,0,0,1,0,0|1,2,0]=4 1412 B7R1.3 S=C1NCCCO1 MCULE-2364674450 [0,0,0,1,0,0|2,1,0]=4 1413 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [0,0,0,1,0,0|2,0,1]=4 1414 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,0,0,1,0,0|2,0,0]=3 1415 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,0,0,1,0,0|3,0,0]=4 1416 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,0,0,1,0,0|3,0,0]=4 1417 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,0,0,1,0,0|2,0,0]=3 1418 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,0,0,1,0,0|2,0,0]=3 1419 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,0,0,1,0,0|1,1,0]=3 1420 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,0,0,1,0,0|1,0,0]=2 1421 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,0,0,1,0,0|2,0,1]=4 1422 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,0,0,1,0,0|3,0,0]=4 1423 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,0,0,1,0,0|3,0,0]=4 1424 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,0,0,1,0,0|3,0,0]=4 1425 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,0,0,1,0,0|3,0,0]=4 1426 B7R1.4 CN1CC=CC1=O MCULE-7879549885 [0,0,0,1,0,0|2,0,1]=4 1427 B7R1.4 CN1CCCC1=O MCULE-1381506705 [0,0,0,1,0,0|2,0,0]=3 1428 B7R1.4 CN1CCCC1=S MCULE-1990879544 [0,0,0,1,0,0|2,1,0]=4 1429 B7R1.4 CN1CCNC1=O MCULE-9774864412 [0,0,0,1,0,0|3,0,0]=4 1430 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,0,0,1,0,0|3,0,0]=4 1431 B7R1.4 CN1CNCC1=O MCULE-2252466841 [0,0,0,1,0,0|2,0,0]=3 1432 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [0,0,0,1,0,0|3,0,0]=4 1433 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,0,0,1,0,0|3,0,0]=4 1434 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,0,0,1,0,0|3,0,0]=4 1435 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,0,0,1,0,0|3,0,0]=4 1436 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,0,0,1,0,0|3,0,0]=4 1437 B7R1.4 NN1CCCC1=O MCULE-2994786381 [0,0,0,1,0,0|3,0,0]=4 1438 B7R1.4 NN1CCCC1=O MCULE-5599329775 [0,0,0,1,0,0|3,0,0]=4 1439 B7R1.4 O=C1CCCC1=O MCULE-8040167119 [0,0,0,1,0,0|3,0,0]=4 1440 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,0,0,1,0,0|3,0,0]=4 1441 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,0,0,1,0,0|3,0,0]=4 1442 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,0,0,1,0,0|3,0,0]=4 1443 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,0,0,1,0,0|3,0,0]=4 1444 B7R1.6 CNCC1CCO1 MCULE-5990606434 [0,0,0,1,0,0|2,0,1]=4 1445 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,0,0,1,0,0|2,0,0]=3 1446 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,0,0,1,0,0|1,1,0]=3 1447 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,0,0,1,0,0|1,0,0]=2 1448 B7R1.8 N#CC1CCC1=O MCULE-3371494435 [0,0,0,1,0,0|3,0,0]=4 1449 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,0,0,1,0,0|3,0,0]=4 1450 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,0,0,1,0,0|3,0,0]=4 1451 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,0,0,1,0,0|2,0,0]=3 1452 B7R1.21 COCC1(CO1)C MCULE-8694642597 [0,0,0,1,0,0|1,1,1]=4 1453 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,0,0,1,0,0|0,1,0]=2 1454 B7R1.22 C=CC(=O)C1CC1 MCULE-4167270466 [0,0,0,1,0,0|2,0,1]=4 1455 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,0,0,1,0,0|2,0,0]=3 1456 B7R1.22 CNC(=O)C1CC1 MCULE-5799863193 [0,0,0,1,0,0|2,0,0]=3 1457 B7R1.22 COC(=N)C1CC1 MCULE-3594886802 [0,0,0,1,0,0|2,0,0]=3 1458 B7R1.22 COC(=N)C1CC1 MCULE-6548060912 [0,0,0,1,0,0|2,0,0]=3 1459 B7R1.22 COC(=O)C1CC1 MCULE-3338113454 [0,0,0,1,0,0|1,0,0]=2 1460 B7R1.22 COC(=O)C1CN1 MCULE-2166427972 [0,0,0,1,0,0|1,0,0]=2 1461 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,0,0,1,0,0|0,1,0]=2 1462 B7R1.22 COC(=O)N1CC1 MCULE-2788788116 [0,0,0,1,0,0|2,0,0]=3 1463 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-1955059175 [0,0,0,1,0,0|1,0,0]=2 1464 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-5011635876 [0,0,0,1,0,0|1,0,0]=2 1465 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,0,0,1,0,0|0,1,0]=2 1466 B7R1.22 COC(=O)[C@H]1CN1 MCULE-5882979938 [0,0,0,1,0,0|1,0,0]=2 1467 B7R1.22 COC(=O)[C@H]1CN1 MCULE-8601280412 [0,0,0,1,0,0|1,0,0]=2 1468 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,0,0,1,0,0|0,1,0]=2 1469 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,0,0,1,0,0|0,1,0]=2 1470 B7R1.22 NCC(=O)C1CC1 MCULE-1927654168 [0,0,0,1,0,0|3,0,0]=4 1471 B7R1.22 NCC(=O)C1CC1 MCULE-4415662894 [0,0,0,1,0,0|3,0,0]=4 1472 B7R1.22 NNC(=O)C1CC1 MCULE-3608531301 [0,0,0,1,0,0|3,0,0]=4 1473 B7R1.22 O=C(CBr)C1CC1 MCULE-1037373080 [0,0,0,1,0,0|3,0,0]=4 1474 B7R1.22 O=C(CCl)C1CC1 MCULE-9791345328 [0,0,0,1,0,0|3,0,0]=4 1475 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,0,0,1,0,0|3,0,0]=4 1476 B7R1.22 O=C(NO)C1CC1 MCULE-2299815322 [0,0,0,1,0,0|3,0,0]=4 1477 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,0,0,1,0,0|0,1,0]=2 1478 B7R1.25 COC1(CNC1)C MCULE-6665716453 [0,0,0,1,0,0|2,0,1]=4 1479 B7R1.25 COC1(CNC1)C MCULE-9047074177 [0,0,0,1,0,0|2,0,1]=4 1480 B4R0.1 C#CC(=O)C MCULE-1296030711 [2,0,0,0,0,0|0,0,2]=4 1481 B4R0.1 C#CC(=O)O MCULE-8764256624 [2,0,0,0,0,0|0,0,2]=4 1482 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [2,0,0,0,0,0|1,0,1]=4 1483 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [2,0,0,0,0,0|1,0,1]=4 1484 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [2,0,0,0,0,0|1,0,1]=4 1485 B4R0.1 C=C(Br)CC MCULE-6271946451 [2,0,0,0,0,0|1,0,1]=4 1486 B4R0.1 C=C(C)CBr MCULE-1361893863 [2,0,0,0,0,0|2,0,0]=4 1487 B4R0.1 C=C(C)CCl MCULE-5586406339 [2,0,0,0,0,0|2,0,0]=4 1488 B4R0.1 C=C(C)CI MCULE-3678124406 [2,0,0,0,0,0|2,0,0]=4 1489 B4R0.1 C=C(C)CN MCULE-1033495975 [2,0,0,0,0,0|2,0,0]=4 1490 B4R0.1 C=C(C)CN MCULE-8730181300 [2,0,0,0,0,0|2,0,0]=4 1491 B4R0.1 C=C(C)CO MCULE-8641288398 [2,0,0,0,0,0|1,1,0]=4 1492 B4R0.1 C=C(C)CS MCULE-5174170431 [2,0,0,0,0,0|1,0,0]=3 1493 B4R0.1 C=C(C)OC MCULE-7344104255 [2,0,0,0,0,0|1,0,0]=3 1494 B4R0.1 C=CC(=O)C MCULE-4924646293 [2,0,0,0,0,0|0,0,2]=4 1495 B4R0.1 C=CC(=O)O MCULE-9352227082 [2,0,0,0,0,0|0,0,2]=4 1496 B4R0.1 CC(=O)C#N MCULE-6317771757 [2,0,0,0,0,0|1,0,1]=4 1497 B4R0.1 CC(=O)C=O MCULE-2718961814 [2,0,0,0,0,0|0,1,1]=4 1498 B4R0.1 CC(=O)CBr MCULE-7812920675 [2,0,0,0,0,0|1,0,0]=3 1499 B4R0.1 CC(=O)CCl MCULE-2501365933 [2,0,0,0,0,0|1,0,0]=3 1500 B4R0.1 CC(=O)CF MCULE-7417279999 [2,0,0,0,0,0|1,0,0]=3 1501 B4R0.1 CC(=O)CN MCULE-2715277783 [2,0,0,0,0,0|1,0,0]=3 1502 B4R0.1 CC(=O)CN MCULE-6004541862 [2,0,0,0,0,0|1,0,0]=3 1503 B4R0.1 CC(=O)CO MCULE-2989526028 [2,0,0,0,0,0|0,1,0]=3 1504 B4R0.1 CC(=O)CS MCULE-9736174016 [2,0,0,0,0,0|0,0,0]=2 1505 B4R0.1 CC(=O)NBr MCULE-6502070876 [2,0,0,0,0,0|2,0,0]=4 1506 B4R0.1 CC(=O)NN MCULE-9183467120 [2,0,0,0,0,0|2,0,0]=4 1507 B4R0.1 CC(=O)NO MCULE-2682231025 [2,0,0,0,0,0|1,1,0]=4 1508 B4R0.1 CC(=O)OO MCULE-6028338742 [2,0,0,0,0,0|1,0,0]=3 1509 B4R0.1 CC(C)CS MCULE-7978911055 [2,0,0,0,0,0|1,0,1]=4 1510 B4R0.1 CC(N)CS MCULE-1396853557 [2,0,0,0,0,0|1,0,1]=4 1511 B4R0.1 CC(N)CS MCULE-4094732666 [2,0,0,0,0,0|1,0,1]=4 1512 B4R0.1 CC(O)CS MCULE-7881083356 [2,0,0,0,0,0|0,0,2]=4 1513 B4R0.1 CC(S)CS MCULE-9264694858 [2,0,0,0,0,0|0,1,1]=4 1514 B4R0.1 CC=C(C)Br MCULE-1371905211 [2,0,0,0,0,0|1,0,1]=4 1515 B4R0.1 CC=C(C)C MCULE-4230157245 [2,0,0,0,0,0|1,0,1]=4 1516 B4R0.1 CC=C(C)Cl MCULE-3844314543 [2,0,0,0,0,0|1,0,1]=4 1517 B4R0.1 CCB(O)O MCULE-1650960999 [2,0,0,0,0,0|1,0,1]=4 1518 B4R0.1 CCC(=N)N MCULE-1856575742 [2,0,0,0,0,0|2,0,0]=4 1519 B4R0.1 CCC(=N)N MCULE-2534386807 [2,0,0,0,0,0|2,0,0]=4 1520 B4R0.1 CCC(=O)Br MCULE-7870678619 [2,0,0,0,0,0|1,0,0]=3 1521 B4R0.1 CCC(=O)C MCULE-8276670748 [2,0,0,0,0,0|0,0,0]=2 1522 B4R0.1 CCC(=O)Cl MCULE-3081874391 [2,0,0,0,0,0|1,0,0]=3 1523 B4R0.1 CCC(=O)F MCULE-8783887670 [2,0,0,0,0,0|1,0,0]=3 1524 B4R0.1 CCC(=O)N MCULE-3730796130 [2,0,0,0,0,0|1,0,0]=3 1525 B4R0.1 CCC(=O)O MCULE-2199051150 [2,0,0,0,0,0|0,0,0]=2 1526 B4R0.1 CCC(=O)O MCULE-9800054040 [2,0,0,0,0,0|0,0,0]=2 1527 B4R0.1 CCC(=O)S MCULE-3392119766 [2,0,0,0,0,0|0,1,0]=3 1528 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [2,0,0,0,0,0|0,0,1]=3 1529 B4R0.1 CCC(=S)N MCULE-3921479699 [2,0,0,0,0,0|1,1,0]=4 1530 B4R0.1 CCC(C)Br MCULE-9661620259 [2,0,0,0,0,0|1,0,1]=4 1531 B4R0.1 CCC(C)C MCULE-5376105936 [2,0,0,0,0,0|1,0,1]=4 1532 B4R0.1 CCC(C)Cl MCULE-2954418486 [2,0,0,0,0,0|1,0,1]=4 1533 B4R0.1 CCC(C)I MCULE-5239699587 [2,0,0,0,0,0|1,0,1]=4 1534 B4R0.1 CCC(C)N MCULE-5041676035 [2,0,0,0,0,0|1,0,1]=4 1535 B4R0.1 CCC(C)N MCULE-5835091553 [2,0,0,0,0,0|1,0,1]=4 1536 B4R0.1 CCC(C)N MCULE-6631606230 [2,0,0,0,0,0|1,0,1]=4 1537 B4R0.1 CCC(C)N MCULE-8165681721 [2,0,0,0,0,0|1,0,1]=4 1538 B4R0.1 CCC(C)O MCULE-4099350806 [2,0,0,0,0,0|0,0,2]=4 1539 B4R0.1 CCC(C)O MCULE-5005120003 [2,0,0,0,0,0|0,0,2]=4 1540 B4R0.1 CCC(C)S MCULE-4988033753 [2,0,0,0,0,0|0,1,1]=4 1541 B4R0.1 CCN(=O)=O MCULE-6603591614 [2,0,0,0,0,0|1,0,1]=4 1542 B4R0.1 CCN(C)C MCULE-5825033552 [2,0,0,0,0,0|2,0,0]=4 1543 B4R0.1 CCN(C)N MCULE-2279492356 [2,0,0,0,0,0|2,0,0]=4 1544 B4R0.1 CCN(C)N MCULE-5660338703 [2,0,0,0,0,0|2,0,0]=4 1545 B4R0.1 CCN(C)N MCULE-9839987578 [2,0,0,0,0,0|2,0,0]=4 1546 B4R0.1 CCS(=O)C MCULE-4400935745 [2,0,0,0,0,0|1,0,0]=3 1547 B4R0.1 CCS(=O)O MCULE-9872932319 [2,0,0,0,0,0|1,0,0]=3 1548 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [2,0,0,0,0,0|1,0,1]=4 1549 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [2,0,0,0,0,0|1,0,1]=4 1550 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [2,0,0,0,0,0|1,0,1]=4 1551 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [2,0,0,0,0,0|1,0,1]=4 1552 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [2,0,0,0,0,0|1,0,1]=4 1553 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [2,0,0,0,0,0|0,0,2]=4 1554 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [2,0,0,0,0,0|0,0,2]=4 1555 B4R0.1 CC[C@H](C)N MCULE-2450201533 [2,0,0,0,0,0|1,0,1]=4 1556 B4R0.1 CC[C@H](C)N MCULE-2998961427 [2,0,0,0,0,0|1,0,1]=4 1557 B4R0.1 CC[C@H](C)N MCULE-6692190471 [2,0,0,0,0,0|1,0,1]=4 1558 B4R0.1 CC[C@H](C)N MCULE-6904795465 [2,0,0,0,0,0|1,0,1]=4 1559 B4R0.1 CC[C@H](C)O MCULE-3700911573 [2,0,0,0,0,0|0,0,2]=4 1560 B4R0.1 CC[C@H](C)O MCULE-6063716138 [2,0,0,0,0,0|0,0,2]=4 1561 B4R0.1 CNC(=O)C MCULE-2612997941 [2,0,0,0,0,0|1,0,0]=3 1562 B4R0.1 CNC(=O)Cl MCULE-7743744606 [2,0,0,0,0,0|2,0,0]=4 1563 B4R0.1 CNC(=O)N MCULE-6422331704 [2,0,0,0,0,0|2,0,0]=4 1564 B4R0.1 CNC(=S)C MCULE-8699171591 [2,0,0,0,0,0|1,1,0]=4 1565 B4R0.1 COC(=N)C MCULE-2752794913 [2,0,0,0,0,0|1,0,0]=3 1566 B4R0.1 COC(=N)C MCULE-2904991083 [2,0,0,0,0,0|1,0,0]=3 1567 B4R0.1 COC(=N)N MCULE-1611076737 [2,0,0,0,0,0|2,0,0]=4 1568 B4R0.1 COC(=N)N MCULE-4923904579 [2,0,0,0,0,0|2,0,0]=4 1569 B4R0.1 COC(=N)N MCULE-6696789855 [2,0,0,0,0,0|2,0,0]=4 1570 B4R0.1 COC(=N)N MCULE-9171600210 [2,0,0,0,0,0|2,0,0]=4 1571 B4R0.1 COC(=O)C MCULE-7368066093 [2,0,0,0,0,0|0,0,0]=2 1572 B4R0.1 COC(=O)Cl MCULE-8022274771 [2,0,0,0,0,0|1,0,0]=3 1573 B4R0.1 COC(=O)N MCULE-4070607369 [2,0,0,0,0,0|1,0,0]=3 1574 B4R0.1 COC(=S)N MCULE-9414558443 [2,0,0,0,0,0|1,0,1]=4 1575 B4R0.1 COC(=S)[S-] MCULE-4829872223 [2,0,0,0,0,0|0,1,1]=4 1576 B4R0.1 COC(=S)[S-] MCULE-6509496630 [2,0,0,0,0,0|0,1,1]=4 1577 B4R0.1 COC(C)Cl MCULE-9043930044 [2,0,0,0,0,0|1,0,1]=4 1578 B4R0.1 CSC(=N)N MCULE-1471368384 [2,0,0,0,0,0|2,0,0]=4 1579 B4R0.1 CSC(=N)N MCULE-3394284504 [2,0,0,0,0,0|2,0,0]=4 1580 B4R0.1 CSC(=N)N MCULE-3752198299 [2,0,0,0,0,0|2,0,0]=4 1581 B4R0.1 CSC(=N)N MCULE-5672446896 [2,0,0,0,0,0|2,0,0]=4 1582 B4R0.1 CSC(=N)N MCULE-8409992127 [2,0,0,0,0,0|2,0,0]=4 1583 B4R0.1 CSC(=O)C MCULE-7061634598 [2,0,0,0,0,0|0,0,0]=2 1584 B4R0.1 CSC(=S)C MCULE-4836153374 [2,0,0,0,0,0|0,1,0]=3 1585 B4R0.1 CSC(C)C MCULE-5932565699 [2,0,0,0,0,0|1,0,1]=4 1586 B4R0.1 CSS(=O)C MCULE-6515592458 [2,0,0,0,0,0|1,0,0]=3 1587 B4R0.1 CS[S+](C)C MCULE-1869043585 [2,0,0,0,0,0|2,0,0]=4 1588 B4R0.1 CS[S+](C)C MCULE-4164877790 [2,0,0,0,0,0|2,0,0]=4 1589 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [2,0,0,0,0,0|0,0,2]=4 1590 B4R0.1 C[C@H](O)CS MCULE-9061842733 [2,0,0,0,0,0|0,0,2]=4 1591 B4R0.1 NC(=O)CBr MCULE-9306090536 [2,0,0,0,0,0|2,0,0]=4 1592 B4R0.1 NC(=O)CCl MCULE-3241549842 [2,0,0,0,0,0|2,0,0]=4 1593 B4R0.1 NC(=O)CF MCULE-3344212657 [2,0,0,0,0,0|2,0,0]=4 1594 B4R0.1 NC(=O)CI MCULE-4217973413 [2,0,0,0,0,0|2,0,0]=4 1595 B4R0.1 NC(=O)CO MCULE-2739878376 [2,0,0,0,0,0|1,1,0]=4 1596 B4R0.1 NC(=O)CS MCULE-2639305532 [2,0,0,0,0,0|1,0,0]=3 1597 B4R0.1 NCC(=O)N MCULE-1048848056 [2,0,0,0,0,0|2,0,0]=4 1598 B4R0.1 NCC(=O)N MCULE-2174395809 [2,0,0,0,0,0|2,0,0]=4 1599 B4R0.1 NCC(=O)N MCULE-6113166250 [2,0,0,0,0,0|2,0,0]=4 1600 B4R0.1 NCC(=O)O MCULE-2415764032 [2,0,0,0,0,0|1,0,0]=3 1601 B4R0.1 NCC(=O)O MCULE-3643110755 [2,0,0,0,0,0|1,0,0]=3 1602 B4R0.1 NCC(=O)O MCULE-4349255299 [2,0,0,0,0,0|1,0,0]=3 1603 B4R0.1 NCC(=O)O MCULE-9146223615 [2,0,0,0,0,0|1,0,0]=3 1604 B4R0.1 NCC(=O)O MCULE-9701991737 [2,0,0,0,0,0|1,0,0]=3 1605 B4R0.1 NCC(=O)S MCULE-9837799864 [2,0,0,0,0,0|1,1,0]=4 1606 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [2,0,0,0,0,0|1,0,1]=4 1607 B4R0.1 O=C(Br)CBr MCULE-6031858200 [2,0,0,0,0,0|2,0,0]=4 1608 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [2,0,0,0,0,0|2,0,0]=4 1609 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [2,0,0,0,0,0|2,0,0]=4 1610 B4R0.1 O=C(Cl)CF MCULE-7182087882 [2,0,0,0,0,0|2,0,0]=4 1611 B4R0.1 O=C(Cl)CI MCULE-5719121455 [2,0,0,0,0,0|2,0,0]=4 1612 B4R0.1 O=C(Cl)SCl MCULE-5008011265 [2,0,0,0,0,0|2,0,0]=4 1613 B4R0.1 O=C(O)CBr MCULE-1503716137 [2,0,0,0,0,0|1,0,0]=3 1614 B4R0.1 O=C(O)CCl MCULE-9228754880 [2,0,0,0,0,0|1,0,0]=3 1615 B4R0.1 O=C(O)CF MCULE-6584094437 [2,0,0,0,0,0|1,0,0]=3 1616 B4R0.1 O=C(O)CI MCULE-3146792857 [2,0,0,0,0,0|1,0,0]=3 1617 B4R0.1 O=C(O)CO MCULE-9792551388 [2,0,0,0,0,0|0,1,0]=3 1618 B4R0.1 O=C(O)CS MCULE-8097997001 [2,0,0,0,0,0|0,0,0]=2 1619 B4R0.1 O=C([O-])CF MCULE-8428965857 [2,0,0,0,0,0|1,0,1]=4 1620 B4R0.1 O=C([O-])CO MCULE-2780567509 [2,0,0,0,0,0|0,1,1]=4 1621 B4R0.1 O=C([O-])CS MCULE-3314809220 [2,0,0,0,0,0|0,0,1]=3 1622 B4R0.1 O=C([O-])CS MCULE-5989133747 [2,0,0,0,0,0|0,0,1]=3 1623 B4R0.1 O=CC(=O)O MCULE-5307898766 [2,0,0,0,0,0|0,1,1]=4 1624 B4R0.1 O=S(O)CO MCULE-4195832185 [2,0,0,0,0,0|1,1,0]=4 1625 B4R0.1 P(=O)(O)CN MCULE-5441171864 [2,0,0,0,0,0|2,0,0]=4 1626 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [2,0,0,0,0,0|1,0,1]=4 1627 B4R0.2 C#CCOC MCULE-9172422462 [2,0,0,0,0,0|1,0,1]=4 1628 B4R0.2 C#CCSC MCULE-6808040899 [2,0,0,0,0,0|0,0,2]=4 1629 B4R0.2 C/C=C/C=O MCULE-9924705308 [2,0,0,0,0,0|1,0,1]=4 1630 B4R0.2 C/C=C/CCl MCULE-9977493525 [2,0,0,0,0,0|2,0,0]=4 1631 B4R0.2 C/C=C/CO MCULE-2383161163 [2,0,0,0,0,0|1,1,0]=4 1632 B4R0.2 C/C=C/OC MCULE-3906920304 [2,0,0,0,0,0|0,0,1]=3 1633 B4R0.2 C/C=C\CO MCULE-5924662327 [2,0,0,0,0,0|1,1,0]=4 1634 B4R0.2 C=C=CCC MCULE-6123315571 [2,0,0,0,0,0|1,0,1]=4 1635 B4R0.2 C=CCCC MCULE-8386546337 [2,0,0,0,0,0|1,0,1]=4 1636 B4R0.2 C=CCNC MCULE-3335720336 [2,0,0,0,0,0|1,0,1]=4 1637 B4R0.2 C=CCOC MCULE-3321225771 [2,0,0,0,0,0|0,1,1]=4 1638 B4R0.2 C=CCSC MCULE-4452023915 [2,0,0,0,0,0|0,0,1]=3 1639 B4R0.2 CC#CC=O MCULE-9270622693 [2,0,0,0,0,0|1,0,1]=4 1640 B4R0.2 CC#CCC MCULE-8848779220 [2,0,0,0,0,0|1,0,1]=4 1641 B4R0.2 CC=CC=O MCULE-2497362981 [2,0,0,0,0,0|1,0,1]=4 1642 B4R0.2 CC=CCBr MCULE-7855581866 [2,0,0,0,0,0|2,0,0]=4 1643 B4R0.2 CC=CCC MCULE-5931905453 [2,0,0,0,0,0|1,0,0]=3 1644 B4R0.2 CC=CCCl MCULE-3941962217 [2,0,0,0,0,0|2,0,0]=4 1645 B4R0.2 CC=CCO MCULE-7490725844 [2,0,0,0,0,0|1,1,0]=4 1646 B4R0.2 CC=COC MCULE-6712403535 [2,0,0,0,0,0|0,0,1]=3 1647 B4R0.2 CC=CSC MCULE-5921906156 [2,0,0,0,0,0|0,0,1]=3 1648 B4R0.2 CCC=CBr MCULE-4471551501 [2,0,0,0,0,0|2,0,0]=4 1649 B4R0.2 CCC=NO MCULE-9457280654 [2,0,0,0,0,0|2,0,0]=4 1650 B4R0.2 CCCC=O MCULE-8530391347 [2,0,0,0,0,0|1,0,0]=3 1651 B4R0.2 CCCCC MCULE-4643148765 [2,0,0,0,0,0|1,0,1]=4 1652 B4R0.2 CCCCO MCULE-1571156443 [2,0,0,0,0,0|1,0,1]=4 1653 B4R0.2 CCCCS MCULE-9441213933 [2,0,0,0,0,0|1,0,1]=4 1654 B4R0.2 CCCNC MCULE-2266616259 [2,0,0,0,0,0|1,0,1]=4 1655 B4R0.2 CCCNC MCULE-7722796872 [2,0,0,0,0,0|1,0,1]=4 1656 B4R0.2 CCCOC MCULE-5854067718 [2,0,0,0,0,0|0,0,1]=3 1657 B4R0.2 CCCON MCULE-4800172637 [2,0,0,0,0,0|1,0,1]=4 1658 B4R0.2 CCCON MCULE-7988781002 [2,0,0,0,0,0|1,0,1]=4 1659 B4R0.2 CCCSC MCULE-8387041737 [2,0,0,0,0,0|0,0,1]=3 1660 B4R0.2 CCNC=O MCULE-9309926274 [2,0,0,0,0,0|2,0,0]=4 1661 B4R0.2 CCNCC MCULE-3395060353 [2,0,0,0,0,0|2,0,0]=4 1662 B4R0.2 CCNCC MCULE-4374609736 [2,0,0,0,0,0|2,0,0]=4 1663 B4R0.2 CCNCC MCULE-4555901025 [2,0,0,0,0,0|2,0,0]=4 1664 B4R0.2 CCNCC MCULE-6895602113 [2,0,0,0,0,0|2,0,0]=4 1665 B4R0.2 CCNOC MCULE-4797714235 [2,0,0,0,0,0|1,0,0]=3 1666 B4R0.2 CCNOC MCULE-6486167423 [2,0,0,0,0,0|1,0,0]=3 1667 B4R0.2 CCOC=O MCULE-6245072161 [2,0,0,0,0,0|2,0,0]=4 1668 B4R0.2 CCOCC MCULE-5665709021 [2,0,0,0,0,0|2,0,0]=4 1669 B4R0.2 CCONC MCULE-5446312516 [2,0,0,0,0,0|2,0,0]=4 1670 B4R0.2 CCONC MCULE-7976027802 [2,0,0,0,0,0|2,0,0]=4 1671 B4R0.2 CCSCC MCULE-6480710239 [2,0,0,0,0,0|2,0,0]=4 1672 B4R0.2 CCSSC MCULE-9430585714 [2,0,0,0,0,0|1,0,1]=4 1673 B4R0.2 CC[NH2+]CC MCULE-9899430356 [2,0,0,0,0,0|2,0,0]=4 1674 B4R0.2 CNCCO MCULE-7051900771 [2,0,0,0,0,0|1,0,1]=4 1675 B4R0.2 CNCCO MCULE-7934732981 [2,0,0,0,0,0|1,0,1]=4 1676 B4R0.2 CNCCS MCULE-6430516369 [2,0,0,0,0,0|1,0,1]=4 1677 B4R0.2 COCC#N MCULE-9178522865 [2,0,0,0,0,0|2,0,0]=4 1678 B4R0.2 COCC=O MCULE-9427361019 [2,0,0,0,0,0|0,1,0]=3 1679 B4R0.2 COCCBr MCULE-8316331262 [2,0,0,0,0,0|1,0,1]=4 1680 B4R0.2 COCCCl MCULE-8886627413 [2,0,0,0,0,0|1,0,1]=4 1681 B4R0.2 COCCI MCULE-9391124374 [2,0,0,0,0,0|1,0,1]=4 1682 B4R0.2 COCCN MCULE-5051556646 [2,0,0,0,0,0|1,0,1]=4 1683 B4R0.2 COCCN MCULE-7519068386 [2,0,0,0,0,0|1,0,1]=4 1684 B4R0.2 COCCO MCULE-4751927883 [2,0,0,0,0,0|0,1,1]=4 1685 B4R0.2 COCCS MCULE-7803276094 [2,0,0,0,0,0|0,0,1]=3 1686 B4R0.2 COCOC MCULE-8559076702 [2,0,0,0,0,0|0,1,0]=3 1687 B4R0.2 COCON MCULE-6032854331 [2,0,0,0,0,0|1,1,0]=4 1688 B4R0.2 CSCC#N MCULE-3607261611 [2,0,0,0,0,0|1,0,1]=4 1689 B4R0.2 CSCCBr MCULE-1684461541 [2,0,0,0,0,0|1,0,1]=4 1690 B4R0.2 CSCCCl MCULE-8593103756 [2,0,0,0,0,0|1,0,1]=4 1691 B4R0.2 CSCCN MCULE-5168245255 [2,0,0,0,0,0|1,0,1]=4 1692 B4R0.2 CSCCN MCULE-6275285732 [2,0,0,0,0,0|1,0,1]=4 1693 B4R0.2 CSCCO MCULE-9706874325 [2,0,0,0,0,0|0,0,1]=3 1694 B4R0.2 CSCSC MCULE-5603964020 [2,0,0,0,0,0|0,1,0]=3 1695 B4R0.2 CSSSC MCULE-4175573612 [2,0,0,0,0,0|1,1,0]=4 1696 B4R0.2 O=CCCBr MCULE-4107157458 [2,0,0,0,0,0|2,0,0]=4 1697 B4R0.2 O=CCCCl MCULE-5863929313 [2,0,0,0,0,0|2,0,0]=4 1698 B4R0.2 O=CCCI MCULE-9771140462 [2,0,0,0,0,0|2,0,0]=4 1699 B4R0.2 O=CCCO MCULE-1685289763 [2,0,0,0,0,0|2,0,0]=4 1700 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [2,0,0,0,0,0|2,0,0]=4 1701 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [1,1,0,0,0,0|1,0,0]=3 1702 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [1,1,0,0,0,0|1,0,0]=3 1703 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [1,1,0,0,0,0|2,0,0]=4 1704 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [1,1,0,0,0,0|2,0,0]=4 1705 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [1,1,0,0,0,0|2,0,0]=4 1706 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [1,1,0,0,0,0|2,0,0]=4 1707 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [1,1,0,0,0,0|1,0,1]=4 1708 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [1,1,0,0,0,0|1,0,1]=4 1709 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [1,1,0,0,0,0|1,0,1]=4 1710 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [1,1,0,0,0,0|1,0,1]=4 1711 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [1,1,0,0,0,0|1,0,1]=4 1712 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [1,1,0,0,0,0|1,0,0]=3 1713 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [1,1,0,0,0,0|1,0,1]=4 1714 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [1,1,0,0,0,0|1,0,1]=4 1715 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [1,1,0,0,0,0|1,0,1]=4 1716 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [1,1,0,0,0,0|1,0,1]=4 1717 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [1,1,0,0,0,0|1,0,1]=4 1718 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [1,1,0,0,0,0|1,0,1]=4 1719 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [1,1,0,0,0,0|1,0,1]=4 1720 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [1,1,0,0,0,0|1,0,1]=4 1721 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [1,1,0,0,0,0|1,0,0]=3 1722 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [1,1,0,0,0,0|2,0,0]=4 1723 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [1,1,0,0,0,0|1,0,0]=3 1724 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [1,1,0,0,0,0|1,0,1]=4 1725 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [1,1,0,0,0,0|1,0,1]=4 1726 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [1,1,0,0,0,0|1,0,0]=3 1727 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [1,1,0,0,0,0|1,0,0]=3 1728 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [1,1,0,0,0,0|1,0,0]=3 1729 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [1,1,0,0,0,0|1,0,0]=3 1730 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [1,1,0,0,0,0|2,0,0]=4 1731 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [1,1,0,0,0,0|1,0,0]=3 1732 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [1,1,0,0,0,0|1,0,0]=3 1733 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [1,1,0,0,0,0|1,0,0]=3 1734 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [1,1,0,0,0,0|2,0,0]=4 1735 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [1,1,0,0,0,0|2,0,0]=4 1736 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [1,1,0,0,0,0|2,0,0]=4 1737 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [1,1,0,0,0,0|2,0,0]=4 1738 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [1,1,0,0,0,0|2,0,0]=4 1739 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [1,1,0,0,0,0|2,0,0]=4 1740 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [1,1,0,0,0,0|2,0,0]=4 1741 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [1,1,0,0,0,0|2,0,0]=4 1742 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [1,1,0,0,0,0|2,0,0]=4 1743 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [1,1,0,0,0,0|1,0,1]=4 1744 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [1,1,0,0,0,0|1,0,1]=4 1745 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [1,1,0,0,0,0|1,0,0]=3 1746 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [1,1,0,0,0,0|2,0,0]=4 1747 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [1,1,0,0,0,0|2,0,0]=4 1748 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [1,1,0,0,0,0|1,0,0]=3 1749 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [1,1,0,0,0,0|2,0,0]=4 1750 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [1,1,0,0,0,0|1,0,0]=3 1751 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [1,1,0,0,0,0|1,0,0]=3 1752 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [1,1,0,0,0,0|2,0,0]=4 1753 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [1,1,0,0,0,0|2,0,0]=4 1754 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [1,1,0,0,0,0|1,0,0]=3 1755 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [1,1,0,0,0,0|1,0,0]=3 1756 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [1,1,0,0,0,0|1,0,0]=3 1757 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [1,1,0,0,0,0|1,0,0]=3 1758 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [1,1,0,0,0,0|2,0,0]=4 1759 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [1,1,0,0,0,0|2,0,0]=4 1760 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [1,1,0,0,0,0|1,0,0]=3 1761 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [1,1,0,0,0,0|1,0,0]=3 1762 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [1,1,0,0,0,0|1,0,1]=4 1763 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [1,1,0,0,0,0|1,0,1]=4 1764 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [1,1,0,0,0,0|2,0,0]=4 1765 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [1,1,0,0,0,0|2,0,0]=4 1766 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [1,1,0,0,0,0|2,0,0]=4 1767 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [1,1,0,0,0,0|2,0,0]=4 1768 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [1,1,0,0,0,0|1,0,0]=3 1769 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [1,1,0,0,0,0|1,0,0]=3 1770 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [1,1,0,0,0,0|1,0,1]=4 1771 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [1,1,0,0,0,0|1,0,0]=3 1772 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [1,1,0,0,0,0|1,0,0]=3 1773 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [1,1,0,0,0,0|1,0,0]=3 1774 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [1,1,0,0,0,0|1,0,0]=3 1775 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [1,1,0,0,0,0|1,0,0]=3 1776 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [1,1,0,0,0,0|1,0,0]=3 1777 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [1,1,0,0,0,0|1,0,1]=4 1778 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [1,1,0,0,0,0|1,0,1]=4 1779 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [1,1,0,0,0,0|1,0,0]=3 1780 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [1,1,0,0,0,0|1,0,0]=3 1781 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [1,1,0,0,0,0|1,0,0]=3 1782 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [1,1,0,0,0,0|1,0,0]=3 1783 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [1,1,0,0,0,0|1,0,0]=3 1784 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [1,1,0,0,0,0|1,0,0]=3 1785 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [1,1,0,0,0,0|1,0,0]=3 1786 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [1,1,0,0,0,0|1,0,0]=3 1787 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [1,1,0,0,0,0|1,0,1]=4 1788 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [1,1,0,0,0,0|1,0,1]=4 1789 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [1,1,0,0,0,0|0,0,2]=4 1790 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [1,1,0,0,0,0|0,0,2]=4 1791 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [1,1,0,0,0,0|2,0,0]=4 1792 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [1,1,0,0,0,0|2,0,0]=4 1793 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [1,1,0,0,0,0|2,0,0]=4 1794 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [1,1,0,0,0,0|2,0,0]=4 1795 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [1,1,0,0,0,0|2,0,0]=4 1796 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [1,1,0,0,0,0|2,0,0]=4 1797 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [1,1,0,0,0,0|2,0,0]=4 1798 B6R0.3 C#CC(O)C(=O)O MCULE-4214673632 [1,1,0,0,0,0|1,0,1]=4 1799 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [1,1,0,0,0,0|0,1,0]=3 1800 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [1,1,0,0,0,0|1,0,1]=4 1801 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [1,1,0,0,0,0|1,0,1]=4 1802 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [1,1,0,0,0,0|1,0,1]=4 1803 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [1,1,0,0,0,0|1,0,1]=4 1804 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,1,0,0,0,0|2,0,0]=4 1805 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,1,0,0,0,0|1,0,1]=4 1806 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [1,1,0,0,0,0|0,1,1]=4 1807 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [1,1,0,0,0,0|1,0,1]=4 1808 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [1,1,0,0,0,0|1,0,1]=4 1809 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [1,1,0,0,0,0|1,0,1]=4 1810 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [1,1,0,0,0,0|1,0,1]=4 1811 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [1,1,0,0,0,0|1,0,1]=4 1812 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [1,1,0,0,0,0|1,0,1]=4 1813 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [1,1,0,0,0,0|1,0,1]=4 1814 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [1,1,0,0,0,0|1,0,1]=4 1815 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [1,1,0,0,0,0|1,0,1]=4 1816 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [1,1,0,0,0,0|1,0,1]=4 1817 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [1,1,0,0,0,0|1,0,1]=4 1818 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [1,1,0,0,0,0|1,0,1]=4 1819 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [1,1,0,0,0,0|1,0,1]=4 1820 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [1,1,0,0,0,0|1,0,1]=4 1821 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [1,1,0,0,0,0|1,0,1]=4 1822 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [1,1,0,0,0,0|1,0,1]=4 1823 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [1,1,0,0,0,0|1,0,1]=4 1824 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [1,1,0,0,0,0|2,0,0]=4 1825 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [1,1,0,0,0,0|2,0,0]=4 1826 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [1,1,0,0,0,0|2,0,0]=4 1827 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,1,0,0,0,0|2,0,0]=4 1828 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [1,1,0,0,0,0|2,0,0]=4 1829 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [1,1,0,0,0,0|2,0,0]=4 1830 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [1,1,0,0,0,0|2,0,0]=4 1831 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [1,1,0,0,0,0|2,0,0]=4 1832 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [1,1,0,0,0,0|2,0,0]=4 1833 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [1,1,0,0,0,0|2,0,0]=4 1834 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [1,1,0,0,0,0|2,0,0]=4 1835 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [1,1,0,0,0,0|2,0,0]=4 1836 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,1,0,0,0,0|2,0,0]=4 1837 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [1,1,0,0,0,0|2,0,0]=4 1838 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [1,1,0,0,0,0|1,1,0]=4 1839 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [1,1,0,0,0,0|1,1,0]=4 1840 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [1,1,0,0,0,0|1,1,0]=4 1841 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [1,1,0,0,0,0|1,1,0]=4 1842 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [1,1,0,0,0,0|1,0,1]=4 1843 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [1,1,0,0,0,0|1,0,1]=4 1844 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [1,1,0,0,0,0|1,0,1]=4 1845 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [1,1,0,0,0,0|1,0,1]=4 1846 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [1,1,0,0,0,0|1,0,1]=4 1847 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [1,1,0,0,0,0|1,0,1]=4 1848 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [1,1,0,0,0,0|1,0,1]=4 1849 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [1,1,0,0,0,0|1,0,1]=4 1850 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [1,1,0,0,0,0|2,0,0]=4 1851 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,1,0,0,0,0|1,0,0]=3 1852 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [1,1,0,0,0,0|2,0,0]=4 1853 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [1,1,0,0,0,0|2,0,0]=4 1854 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,1,0,0,0,0|1,0,0]=3 1855 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,1,0,0,0,0|1,0,0]=3 1856 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [1,1,0,0,0,0|2,0,0]=4 1857 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [1,1,0,0,0,0|2,0,0]=4 1858 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,1,0,0,0,0|1,0,0]=3 1859 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,1,0,0,0,0|1,0,0]=3 1860 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [1,1,0,0,0,0|2,0,0]=4 1861 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [1,1,0,0,0,0|2,0,0]=4 1862 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,1,0,0,0,0|1,0,0]=3 1863 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,1,0,0,0,0|1,0,0]=3 1864 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [1,1,0,0,0,0|2,0,0]=4 1865 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [1,1,0,0,0,0|2,0,0]=4 1866 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [1,1,0,0,0,0|2,0,0]=4 1867 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [1,1,0,0,0,0|2,0,0]=4 1868 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,1,0,0,0,0|1,0,0]=3 1869 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,1,0,0,0,0|1,0,0]=3 1870 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,1,0,0,0,0|1,0,0]=3 1871 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,1,0,0,0,0|1,0,0]=3 1872 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [1,1,0,0,0,0|2,0,0]=4 1873 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,1,0,0,0,0|1,0,0]=3 1874 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,1,0,0,0,0|1,0,0]=3 1875 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [1,1,0,0,0,0|1,0,1]=4 1876 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [1,1,0,0,0,0|1,0,1]=4 1877 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,1,0,0,0,0|1,0,0]=3 1878 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,1,0,0,0,0|1,0,0]=3 1879 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [1,1,0,0,0,0|2,0,0]=4 1880 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [1,1,0,0,0,0|2,0,0]=4 1881 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,1,0,0,0,0|1,0,0]=3 1882 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,1,0,0,0,0|1,0,0]=3 1883 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [1,1,0,0,0,0|2,0,0]=4 1884 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [1,1,0,0,0,0|2,0,0]=4 1885 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,1,0,0,0,0|1,0,0]=3 1886 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,1,0,0,0,0|1,0,0]=3 1887 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,1,0,0,0,0|1,0,0]=3 1888 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,1,0,0,0,0|1,0,0]=3 1889 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [1,1,0,0,0,0|2,0,0]=4 1890 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [1,1,0,0,0,0|2,0,0]=4 1891 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [1,1,0,0,0,0|2,0,0]=4 1892 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [1,1,0,0,0,0|2,0,0]=4 1893 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,1,0,0,0,0|1,0,0]=3 1894 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,1,0,0,0,0|1,0,0]=3 1895 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,1,0,0,0,0|1,0,0]=3 1896 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,1,0,0,0,0|1,0,0]=3 1897 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,1,0,0,0,0|1,0,0]=3 1898 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,1,0,0,0,0|1,0,0]=3 1899 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,1,0,0,0,0|1,0,0]=3 1900 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,1,0,0,0,0|1,0,0]=3 1901 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,1,0,0,0,0|1,0,0]=3 1902 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,1,0,0,0,0|1,0,0]=3 1903 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,1,0,0,0,0|1,0,0]=3 1904 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [1,1,0,0,0,0|2,0,0]=4 1905 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [1,1,0,0,0,0|2,0,0]=4 1906 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [1,1,0,0,0,0|2,0,0]=4 1907 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [1,1,0,0,0,0|2,0,0]=4 1908 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,1,0,0,0,0|1,0,0]=3 1909 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,1,0,0,0,0|1,0,0]=3 1910 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,1,0,0,0,0|1,0,0]=3 1911 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,1,0,0,0,0|1,0,0]=3 1912 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,1,0,0,0,0|1,1,0]=4 1913 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,1,0,0,0,0|1,1,0]=4 1914 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,1,0,0,0,0|1,0,0]=3 1915 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,1,0,0,0,0|1,0,0]=3 1916 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [1,1,0,0,0,0|1,0,1]=4 1917 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [1,1,0,0,0,0|1,0,1]=4 1918 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [1,1,0,0,0,0|2,0,0]=4 1919 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [1,1,0,0,0,0|2,0,0]=4 1920 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [1,1,0,0,0,0|1,0,0]=3 1921 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [1,1,0,0,0,0|1,0,0]=3 1922 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [1,1,0,0,0,0|1,0,0]=3 1923 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [1,1,0,0,0,0|2,0,0]=4 1924 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [1,1,0,0,0,0|1,0,0]=3 1925 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [1,1,0,0,0,0|1,0,0]=3 1926 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [1,1,0,0,0,0|1,0,0]=3 1927 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [1,1,0,0,0,0|1,0,0]=3 1928 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [1,1,0,0,0,0|1,0,0]=3 1929 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [1,1,0,0,0,0|1,0,0]=3 1930 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [1,1,0,0,0,0|1,0,0]=3 1931 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [1,1,0,0,0,0|0,1,1]=4 1932 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [1,1,0,0,0,0|0,1,1]=4 1933 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [1,1,0,0,0,0|0,1,0]=3 1934 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [1,1,0,0,0,0|0,1,0]=3 1935 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [1,1,0,0,0,0|0,1,0]=3 1936 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [1,1,0,0,0,0|1,1,0]=4 1937 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [1,1,0,0,0,0|0,1,0]=3 1938 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [1,1,0,0,0,0|1,1,0]=4 1939 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [1,1,0,0,0,0|1,1,0]=4 1940 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [1,1,0,0,0,0|0,1,0]=3 1941 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [1,1,0,0,0,0|0,1,0]=3 1942 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [1,1,0,0,0,0|0,1,0]=3 1943 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [1,1,0,0,0,0|0,1,0]=3 1944 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [1,1,0,0,0,0|0,0,0]=2 1945 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [1,1,0,0,0,0|0,0,0]=2 1946 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [1,1,0,0,0,0|0,0,2]=4 1947 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [1,1,0,0,0,0|2,0,0]=4 1948 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [1,1,0,0,0,0|2,0,0]=4 1949 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [1,1,0,0,0,0|2,0,0]=4 1950 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [1,1,0,0,0,0|2,0,0]=4 1951 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,1,0,0,0,0|2,0,0]=4 1952 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,1,0,0,0,0|2,0,0]=4 1953 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [1,1,0,0,0,0|1,1,0]=4 1954 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [1,1,0,0,0,0|1,1,0]=4 1955 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [1,1,0,0,0,0|2,0,0]=4 1956 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [1,1,0,0,0,0|2,0,0]=4 1957 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [1,1,0,0,0,0|2,0,0]=4 1958 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [1,1,0,0,0,0|2,0,0]=4 1959 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,1,0,0,0,0|2,0,0]=4 1960 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,1,0,0,0,0|2,0,0]=4 1961 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [1,1,0,0,0,0|1,1,0]=4 1962 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [1,1,0,0,0,0|1,1,0]=4 1963 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [1,1,0,0,0,0|2,0,0]=4 1964 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [1,1,0,0,0,0|2,0,0]=4 1965 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [1,1,0,0,0,0|2,0,0]=4 1966 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [1,1,0,0,0,0|2,0,0]=4 1967 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [1,1,0,0,0,0|2,0,0]=4 1968 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [1,1,0,0,0,0|2,0,0]=4 1969 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [1,1,0,0,0,0|2,0,0]=4 1970 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [1,1,0,0,0,0|2,0,0]=4 1971 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [1,1,0,0,0,0|2,0,0]=4 1972 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [1,1,0,0,0,0|2,0,0]=4 1973 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [1,1,0,0,0,0|2,0,0]=4 1974 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [1,1,0,0,0,0|2,0,0]=4 1975 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [1,1,0,0,0,0|2,0,0]=4 1976 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [1,1,0,0,0,0|2,0,0]=4 1977 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [1,1,0,0,0,0|2,0,0]=4 1978 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [1,1,0,0,0,0|2,0,0]=4 1979 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [1,1,0,0,0,0|2,0,0]=4 1980 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [1,1,0,0,0,0|2,0,0]=4 1981 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [1,1,0,0,0,0|2,0,0]=4 1982 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [1,1,0,0,0,0|2,0,0]=4 1983 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [1,1,0,0,0,0|2,0,0]=4 1984 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [1,1,0,0,0,0|2,0,0]=4 1985 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [1,1,0,0,0,0|2,0,0]=4 1986 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [1,1,0,0,0,0|2,0,0]=4 1987 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [1,1,0,0,0,0|2,0,0]=4 1988 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [1,1,0,0,0,0|2,0,0]=4 1989 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [1,1,0,0,0,0|2,0,0]=4 1990 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [1,1,0,0,0,0|2,0,0]=4 1991 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [1,1,0,0,0,0|2,0,0]=4 1992 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [1,1,0,0,0,0|2,0,0]=4 1993 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [1,1,0,0,0,0|2,0,0]=4 1994 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [1,1,0,0,0,0|2,0,0]=4 1995 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [1,1,0,0,0,0|2,0,0]=4 1996 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [1,1,0,0,0,0|2,0,0]=4 1997 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [1,1,0,0,0,0|2,0,0]=4 1998 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [1,1,0,0,0,0|2,0,0]=4 1999 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [1,1,0,0,0,0|2,0,0]=4 2000 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [1,1,0,0,0,0|2,0,0]=4 2001 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [1,1,0,0,0,0|2,0,0]=4 2002 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [1,1,0,0,0,0|2,0,0]=4 2003 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [1,1,0,0,0,0|2,0,0]=4 2004 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [1,1,0,0,0,0|2,0,0]=4 2005 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [1,1,0,0,0,0|2,0,0]=4 2006 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [1,1,0,0,0,0|2,0,0]=4 2007 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [1,1,0,0,0,0|2,0,0]=4 2008 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [1,1,0,0,0,0|2,0,0]=4 2009 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [1,1,0,0,0,0|2,0,0]=4 2010 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [1,1,0,0,0,0|2,0,0]=4 2011 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [1,1,0,0,0,0|2,0,0]=4 2012 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [1,1,0,0,0,0|2,0,0]=4 2013 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [1,1,0,0,0,0|2,0,0]=4 2014 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [1,1,0,0,0,0|2,0,0]=4 2015 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [1,1,0,0,0,0|2,0,0]=4 2016 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [1,1,0,0,0,0|2,0,0]=4 2017 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [1,1,0,0,0,0|2,0,0]=4 2018 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [1,1,0,0,0,0|2,0,0]=4 2019 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [1,1,0,0,0,0|2,0,0]=4 2020 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [1,1,0,0,0,0|2,0,0]=4 2021 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [1,1,0,0,0,0|2,0,0]=4 2022 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [1,1,0,0,0,0|2,0,0]=4 2023 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [1,1,0,0,0,0|2,0,0]=4 2024 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [1,1,0,0,0,0|2,0,0]=4 2025 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [1,1,0,0,0,0|2,0,0]=4 2026 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [1,1,0,0,0,0|2,0,0]=4 2027 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [1,1,0,0,0,0|2,0,0]=4 2028 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [1,1,0,0,0,0|2,0,0]=4 2029 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [1,1,0,0,0,0|2,0,0]=4 2030 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [1,1,0,0,0,0|2,0,0]=4 2031 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [1,1,0,0,0,0|2,0,0]=4 2032 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [1,1,0,0,0,0|2,0,0]=4 2033 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [1,1,0,0,0,0|2,0,0]=4 2034 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [1,1,0,0,0,0|2,0,0]=4 2035 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [1,1,0,0,0,0|2,0,0]=4 2036 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [1,1,0,0,0,0|2,0,0]=4 2037 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [1,1,0,0,0,0|2,0,0]=4 2038 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [1,1,0,0,0,0|2,0,0]=4 2039 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [1,1,0,0,0,0|2,0,0]=4 2040 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [1,1,0,0,0,0|2,0,0]=4 2041 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [1,1,0,0,0,0|2,0,0]=4 2042 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [1,1,0,0,0,0|2,0,0]=4 2043 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [1,1,0,0,0,0|2,0,0]=4 2044 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [1,1,0,0,0,0|2,0,0]=4 2045 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [1,1,0,0,0,0|2,0,0]=4 2046 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [1,1,0,0,0,0|1,0,1]=4 2047 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [1,1,0,0,0,0|2,0,0]=4 2048 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [1,1,0,0,0,0|1,0,0]=3 2049 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,1,0,0,0,0|1,0,0]=3 2050 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [1,1,0,0,0,0|2,0,0]=4 2051 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [1,1,0,0,0,0|1,0,1]=4 2052 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [1,1,0,0,0,0|1,0,1]=4 2053 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [1,1,0,0,0,0|1,0,1]=4 2054 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [1,1,0,0,0,0|1,0,1]=4 2055 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [1,1,0,0,0,0|2,0,0]=4 2056 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [1,1,0,0,0,0|2,0,0]=4 2057 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [1,1,0,0,0,0|1,0,0]=3 2058 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [1,1,0,0,0,0|2,0,0]=4 2059 B6R0.4 C=C(C)CCCC MCULE-1010177756 [1,1,0,0,0,0|2,0,0]=4 2060 B6R0.4 C=C(C)CCCO MCULE-4629274490 [1,1,0,0,0,0|2,0,0]=4 2061 B6R0.4 C=C(C)CNCC MCULE-2237759977 [1,1,0,0,0,0|2,0,0]=4 2062 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [1,1,0,0,0,0|1,0,1]=4 2063 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [1,1,0,0,0,0|1,0,1]=4 2064 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [1,1,0,0,0,0|1,0,1]=4 2065 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [1,1,0,0,0,0|1,0,1]=4 2066 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [1,1,0,0,0,0|1,0,1]=4 2067 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [1,1,0,0,0,0|1,0,1]=4 2068 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [1,1,0,0,0,0|1,0,0]=3 2069 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [1,1,0,0,0,0|1,0,1]=4 2070 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [1,1,0,0,0,0|1,0,1]=4 2071 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [1,1,0,0,0,0|1,0,0]=3 2072 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [1,1,0,0,0,0|1,0,0]=3 2073 B6R0.4 CC(=O)CCCO MCULE-1335342150 [1,1,0,0,0,0|1,0,0]=3 2074 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [1,1,0,0,0,0|0,0,1]=3 2075 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [1,1,0,0,0,0|2,0,0]=4 2076 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [1,1,0,0,0,0|2,0,0]=4 2077 B6R0.4 CC(=O)NCCN MCULE-2230084818 [1,1,0,0,0,0|2,0,0]=4 2078 B6R0.4 CC(=O)NCCO MCULE-5968518415 [1,1,0,0,0,0|2,0,0]=4 2079 B6R0.4 CC(=O)NCCS MCULE-3345813615 [1,1,0,0,0,0|2,0,0]=4 2080 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [1,1,0,0,0,0|2,0,0]=4 2081 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [1,1,0,0,0,0|2,0,0]=4 2082 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [1,1,0,0,0,0|2,0,0]=4 2083 B6R0.4 CC(=O)OCCN MCULE-4530529900 [1,1,0,0,0,0|2,0,0]=4 2084 B6R0.4 CC(=O)OCCN MCULE-6854340494 [1,1,0,0,0,0|2,0,0]=4 2085 B6R0.4 CC(=O)OCCO MCULE-1251660436 [1,1,0,0,0,0|2,0,0]=4 2086 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [1,1,0,0,0,0|2,0,0]=4 2087 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [1,1,0,0,0,0|2,0,0]=4 2088 B6R0.4 CC(=O)SCCN MCULE-3819903256 [1,1,0,0,0,0|2,0,0]=4 2089 B6R0.4 CC(=O)SCCN MCULE-4872130470 [1,1,0,0,0,0|2,0,0]=4 2090 B6R0.4 CC(=O)SCCN MCULE-7084821345 [1,1,0,0,0,0|2,0,0]=4 2091 B6R0.4 CC(C)CSCCl MCULE-5218455619 [1,1,0,0,0,0|1,0,1]=4 2092 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [1,1,0,0,0,0|1,0,1]=4 2093 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [1,1,0,0,0,0|1,0,0]=3 2094 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [1,1,0,0,0,0|1,0,1]=4 2095 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [1,1,0,0,0,0|1,0,1]=4 2096 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [1,1,0,0,0,0|1,0,1]=4 2097 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [1,1,0,0,0,0|1,0,1]=4 2098 B6R0.4 CCCC=C(C)C MCULE-2110588796 [1,1,0,0,0,0|2,0,0]=4 2099 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [1,1,0,0,0,0|2,0,0]=4 2100 B6R0.4 CCCCC(=O)C MCULE-3554390184 [1,1,0,0,0,0|1,0,0]=3 2101 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [1,1,0,0,0,0|2,0,0]=4 2102 B6R0.4 CCCCC(=O)N MCULE-6419483436 [1,1,0,0,0,0|2,0,0]=4 2103 B6R0.4 CCCCC(=O)O MCULE-2333640078 [1,1,0,0,0,0|1,0,0]=3 2104 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [1,1,0,0,0,0|1,0,1]=4 2105 B6R0.4 CCCNC(=O)C MCULE-5899703886 [1,1,0,0,0,0|1,0,0]=3 2106 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [1,1,0,0,0,0|2,0,0]=4 2107 B6R0.4 CCCNC(=O)N MCULE-8528844765 [1,1,0,0,0,0|2,0,0]=4 2108 B6R0.4 CCCOC(=O)C MCULE-7327042566 [1,1,0,0,0,0|1,0,0]=3 2109 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [1,1,0,0,0,0|2,0,0]=4 2110 B6R0.4 CCCOC(=O)N MCULE-2760622567 [1,1,0,0,0,0|2,0,0]=4 2111 B6R0.4 CCCSC(=O)C MCULE-4329646671 [1,1,0,0,0,0|1,0,0]=3 2112 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [1,1,0,0,0,0|2,0,0]=4 2113 B6R0.4 CCNCC(=O)C MCULE-5799315547 [1,1,0,0,0,0|1,0,0]=3 2114 B6R0.4 CCNCC(=O)C MCULE-9258294157 [1,1,0,0,0,0|1,0,0]=3 2115 B6R0.4 CCNCC(=O)N MCULE-1787248899 [1,1,0,0,0,0|2,0,0]=4 2116 B6R0.4 CCNCC(=O)N MCULE-3821700273 [1,1,0,0,0,0|2,0,0]=4 2117 B6R0.4 CCNCC(=O)O MCULE-5989480216 [1,1,0,0,0,0|1,0,0]=3 2118 B6R0.4 CCNCC(=O)O MCULE-8087863397 [1,1,0,0,0,0|1,0,0]=3 2119 B6R0.4 CCOCC(=O)C MCULE-2825677443 [1,1,0,0,0,0|0,1,0]=3 2120 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [1,1,0,0,0,0|1,1,0]=4 2121 B6R0.4 CCOCC(=O)O MCULE-1726530898 [1,1,0,0,0,0|0,1,0]=3 2122 B6R0.4 CCSCC(=O)C MCULE-9872082780 [1,1,0,0,0,0|0,0,0]=2 2123 B6R0.4 CCSCC(=O)O MCULE-7471335718 [1,1,0,0,0,0|0,0,0]=2 2124 B6R0.4 CCSCC(C)N MCULE-3399255190 [1,1,0,0,0,0|1,0,1]=4 2125 B6R0.4 CNCCC(=O)N MCULE-1118876220 [1,1,0,0,0,0|2,0,0]=4 2126 B6R0.4 CNCCC(=O)N MCULE-6679713144 [1,1,0,0,0,0|2,0,0]=4 2127 B6R0.4 CNCCC(=O)O MCULE-3627988097 [1,1,0,0,0,0|1,0,0]=3 2128 B6R0.4 CNCCC(=O)O MCULE-9858204248 [1,1,0,0,0,0|1,0,0]=3 2129 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [1,1,0,0,0,0|0,1,1]=4 2130 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [1,1,0,0,0,0|0,1,1]=4 2131 B6R0.4 COC=CC(=O)C MCULE-4868833764 [1,1,0,0,0,0|0,1,1]=4 2132 B6R0.4 COC=CC(=O)O MCULE-4252899122 [1,1,0,0,0,0|0,1,1]=4 2133 B6R0.4 COCCC(=O)C MCULE-5939812376 [1,1,0,0,0,0|0,1,0]=3 2134 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [1,1,0,0,0,0|1,1,0]=4 2135 B6R0.4 COCCC(=O)N MCULE-7556483675 [1,1,0,0,0,0|1,1,0]=4 2136 B6R0.4 COCCC(=O)O MCULE-3436347115 [1,1,0,0,0,0|0,1,0]=3 2137 B6R0.4 COCNC(=O)N MCULE-8367032240 [1,1,0,0,0,0|1,1,0]=4 2138 B6R0.4 COCOC(=O)C MCULE-8876091916 [1,1,0,0,0,0|0,1,0]=3 2139 B6R0.4 CON=CC(=O)O MCULE-6800819509 [1,1,0,0,0,0|0,1,1]=4 2140 B6R0.4 CS(=O)CCCN MCULE-1124989526 [1,1,0,0,0,0|2,0,0]=4 2141 B6R0.4 CS(=O)CCCN MCULE-8758903495 [1,1,0,0,0,0|2,0,0]=4 2142 B6R0.4 CSCCC(=N)N MCULE-3926353306 [1,1,0,0,0,0|2,0,0]=4 2143 B6R0.4 CSCCC(=N)N MCULE-4451485733 [1,1,0,0,0,0|2,0,0]=4 2144 B6R0.4 CSCCC(=O)C MCULE-6178663156 [1,1,0,0,0,0|0,0,0]=2 2145 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [1,1,0,0,0,0|1,0,0]=3 2146 B6R0.4 CSCCC(=O)N MCULE-7105035733 [1,1,0,0,0,0|1,0,0]=3 2147 B6R0.4 CSCCC(=O)O MCULE-9550032941 [1,1,0,0,0,0|0,0,0]=2 2148 B6R0.4 CSCCC(C)N MCULE-3925048385 [1,1,0,0,0,0|1,0,1]=4 2149 B6R0.4 CSCCC(C)O MCULE-5934844952 [1,1,0,0,0,0|0,0,2]=4 2150 B6R0.4 CSCCN(C)C MCULE-2148124964 [1,1,0,0,0,0|2,0,0]=4 2151 B6R0.4 CSCCN(C)C MCULE-5176242697 [1,1,0,0,0,0|2,0,0]=4 2152 B6R0.4 CSCOC(=O)C MCULE-1498769347 [1,1,0,0,0,0|0,0,0]=2 2153 B6R0.4 CSSCC(=O)O MCULE-5829510166 [1,1,0,0,0,0|0,0,0]=2 2154 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [1,1,0,0,0,0|1,0,1]=4 2155 B6R0.4 N#C[Se]CC(=O)O MCULE-1382907788 [1,1,0,0,0,0|0,1,1]=4 2156 B6R0.4 N#N=NCC(=O)O MCULE-3031425162 [1,1,0,0,0,0|2,0,0]=4 2157 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [1,1,0,0,0,0|2,0,0]=4 2158 B6R0.4 NC(=O)CCCO MCULE-3779341561 [1,1,0,0,0,0|2,0,0]=4 2159 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [1,1,0,0,0,0|1,0,1]=4 2160 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [1,1,0,0,0,0|1,0,1]=4 2161 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [1,1,0,0,0,0|1,0,1]=4 2162 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [1,1,0,0,0,0|1,0,1]=4 2163 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [1,1,0,0,0,0|2,0,0]=4 2164 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [1,1,0,0,0,0|2,0,0]=4 2165 B6R0.4 NCCCC(=O)N MCULE-8039142092 [1,1,0,0,0,0|2,0,0]=4 2166 B6R0.4 NCCCC(=O)N MCULE-8262250872 [1,1,0,0,0,0|2,0,0]=4 2167 B6R0.4 NCCCC(=O)O MCULE-3615304273 [1,1,0,0,0,0|1,0,0]=3 2168 B6R0.4 NCCCC(=O)O MCULE-7613134021 [1,1,0,0,0,0|1,0,0]=3 2169 B6R0.4 NOCCC(=O)O MCULE-1529492904 [1,1,0,0,0,0|1,1,0]=4 2170 B6R0.4 NOCCC(=O)O MCULE-6297331357 [1,1,0,0,0,0|1,1,0]=4 2171 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [1,1,0,0,0,0|2,0,0]=4 2172 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [1,1,0,0,0,0|2,0,0]=4 2173 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [1,1,0,0,0,0|1,0,1]=4 2174 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [1,1,0,0,0,0|1,0,1]=4 2175 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [1,1,0,0,0,0|1,0,1]=4 2176 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [1,1,0,0,0,0|1,0,1]=4 2177 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [1,1,0,0,0,0|1,0,1]=4 2178 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [1,1,0,0,0,0|1,0,1]=4 2179 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [1,1,0,0,0,0|1,0,1]=4 2180 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [1,1,0,0,0,0|1,0,1]=4 2181 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [1,1,0,0,0,0|1,0,1]=4 2182 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [1,1,0,0,0,0|1,0,0]=3 2183 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [1,1,0,0,0,0|1,0,0]=3 2184 B6R0.4 O=C(O)CCCF MCULE-2415675768 [1,1,0,0,0,0|1,0,0]=3 2185 B6R0.4 O=C(O)CCCI MCULE-7794841553 [1,1,0,0,0,0|1,0,0]=3 2186 B6R0.4 O=C(O)CCCS MCULE-3352840152 [1,1,0,0,0,0|1,0,0]=3 2187 B6R0.4 O=C(O)CNCO MCULE-4092998319 [1,1,0,0,0,0|1,0,0]=3 2188 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [1,1,0,0,0,0|1,0,1]=4 2189 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [1,1,0,0,0,0|1,0,1]=4 2190 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [1,1,0,0,0,0|1,0,1]=4 2191 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [1,1,0,0,0,0|1,0,1]=4 2192 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [1,1,0,0,0,0|2,0,0]=4 2193 B6R0.5 CCCS(=O)(=O)O MCULE-5213264344 [1,1,0,0,0,0|2,0,0]=4 2194 B6R0.5 CNCP(=O)(O)O MCULE-6684762988 [1,1,0,0,0,0|2,0,0]=4 2195 B6R0.5 CSCC(C)(C)N MCULE-9697189381 [1,1,0,0,0,0|1,0,1]=4 2196 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [1,1,0,0,0,0|2,0,0]=4 2197 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,1,0,0,0,0|2,0,0]=4 2198 B6R0.6 C/C=C/CCCO MCULE-9865436125 [1,1,0,0,0,0|2,0,0]=4 2199 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,1,0,0,0,0|2,0,0]=4 2200 B6R0.6 C/C=C\CCCO MCULE-3169839661 [1,1,0,0,0,0|2,0,0]=4 2201 B6R0.6 CC/C=C/CCC MCULE-5222700461 [1,1,0,0,0,0|2,0,0]=4 2202 B6R0.6 CC=CCCCBr MCULE-1109208969 [1,1,0,0,0,0|2,0,0]=4 2203 B6R0.6 CC=CCCCC MCULE-7277981733 [1,1,0,0,0,0|2,0,0]=4 2204 B6R0.6 CC=CCCCCl MCULE-7487798637 [1,1,0,0,0,0|2,0,0]=4 2205 B6R0.6 CC=CCCCO MCULE-1401303632 [1,1,0,0,0,0|2,0,0]=4 2206 B6R0.6 CC=CSCCC MCULE-3534082442 [1,1,0,0,0,0|2,0,0]=4 2207 B6R0.6 CCC=CCCC MCULE-3739501724 [1,1,0,0,0,0|2,0,0]=4 2208 B6R0.6 CCC=COCC MCULE-1991976030 [1,1,0,0,0,0|1,0,1]=4 2209 B6R0.6 CCCC=CCBr MCULE-2474104566 [1,1,0,0,0,0|2,0,0]=4 2210 B6R0.6 CCCC=CCO MCULE-3204738641 [1,1,0,0,0,0|2,0,0]=4 2211 B6R0.6 CCCCCOC MCULE-3370181741 [1,1,0,0,0,0|1,0,1]=4 2212 B6R0.6 CCCCCSC MCULE-6566108868 [1,1,0,0,0,0|1,0,1]=4 2213 B6R0.6 CCCCNOC MCULE-4265481432 [1,1,0,0,0,0|1,0,1]=4 2214 B6R0.6 CCCCOCC MCULE-5662731951 [1,1,0,0,0,0|1,0,1]=4 2215 B6R0.6 CCCCOCCl MCULE-5282964693 [1,1,0,0,0,0|1,0,1]=4 2216 B6R0.6 CCCCSCC MCULE-4832924468 [1,1,0,0,0,0|1,0,1]=4 2217 B6R0.6 CCCCSCCl MCULE-4907770015 [1,1,0,0,0,0|1,0,1]=4 2218 B6R0.6 CCCNOCC MCULE-1349462426 [1,1,0,0,0,0|2,0,0]=4 2219 B6R0.6 CCCNOCC MCULE-7159087335 [1,1,0,0,0,0|2,0,0]=4 2220 B6R0.6 CCNCCOC MCULE-1476772953 [1,1,0,0,0,0|1,0,1]=4 2221 B6R0.6 CCNCCOC MCULE-6652489795 [1,1,0,0,0,0|1,0,1]=4 2222 B6R0.6 CCNCCSC MCULE-1736157320 [1,1,0,0,0,0|1,0,1]=4 2223 B6R0.6 CCNCCSC MCULE-9369049891 [1,1,0,0,0,0|1,0,1]=4 2224 B6R0.6 CCOCCNC MCULE-5244682559 [1,1,0,0,0,0|1,0,1]=4 2225 B6R0.6 CCOCCNC MCULE-9344296133 [1,1,0,0,0,0|1,0,1]=4 2226 B6R0.6 CCOCCOC MCULE-2753000412 [1,1,0,0,0,0|0,1,1]=4 2227 B6R0.6 CCSCCNC MCULE-6159594076 [1,1,0,0,0,0|1,0,1]=4 2228 B6R0.6 CCSCCNC MCULE-6696154047 [1,1,0,0,0,0|1,0,1]=4 2229 B6R0.6 CCSCSCC MCULE-6005869091 [1,1,0,0,0,0|2,0,0]=4 2230 B6R0.6 CNCCCOC MCULE-4057126907 [1,1,0,0,0,0|1,0,1]=4 2231 B6R0.6 CNCCCOC MCULE-8552551858 [1,1,0,0,0,0|1,0,1]=4 2232 B6R0.6 CNCCCSC MCULE-6553998750 [1,1,0,0,0,0|1,0,1]=4 2233 B6R0.6 CNOCCOC MCULE-2652662364 [1,1,0,0,0,0|0,1,1]=4 2234 B6R0.6 CNOCCOC MCULE-3394597000 [1,1,0,0,0,0|0,1,1]=4 2235 B6R0.6 CO/N=C/NOC MCULE-8041255040 [1,1,0,0,0,0|1,1,0]=4 2236 B6R0.6 COC=CCC#N MCULE-8939260341 [1,1,0,0,0,0|2,0,0]=4 2237 B6R0.6 COCCCCBr MCULE-7500019583 [1,1,0,0,0,0|1,0,1]=4 2238 B6R0.6 COCCCCCl MCULE-3863170338 [1,1,0,0,0,0|1,0,1]=4 2239 B6R0.6 COCCCCN MCULE-9584631056 [1,1,0,0,0,0|1,0,1]=4 2240 B6R0.6 COCCCCO MCULE-2543196930 [1,1,0,0,0,0|1,0,1]=4 2241 B6R0.6 COCCCCO MCULE-8659106280 [1,1,0,0,0,0|1,0,1]=4 2242 B6R0.6 COCCCOC MCULE-5003816236 [1,1,0,0,0,0|0,1,1]=4 2243 B6R0.6 COCCOCCl MCULE-6701095927 [1,1,0,0,0,0|0,1,1]=4 2244 B6R0.6 COCOCOC MCULE-9183615159 [1,1,0,0,0,0|0,1,1]=4 2245 B6R0.6 CONCCCN MCULE-4780444103 [1,1,0,0,0,0|2,0,0]=4 2246 B6R0.6 CONCCCN MCULE-6095720673 [1,1,0,0,0,0|2,0,0]=4 2247 B6R0.6 CONCCCN MCULE-9121351484 [1,1,0,0,0,0|2,0,0]=4 2248 B6R0.6 CSCCCCN MCULE-2391033479 [1,1,0,0,0,0|1,0,1]=4 2249 B6R0.6 CSCCCCO MCULE-1045422424 [1,1,0,0,0,0|1,0,1]=4 2250 B6R0.6 CSCCCON MCULE-2543326517 [1,1,0,0,0,0|1,0,1]=4 2251 B6R0.6 CSCCCSC MCULE-6993538101 [1,1,0,0,0,0|0,1,1]=4 2252 B6R0.8 CCC(C)(C)OC MCULE-3328037871 [1,1,0,0,0,0|1,0,1]=4 2253 B6R0.8 CCP(=O)(O)CC MCULE-3198153356 [1,1,0,0,0,0|2,0,0]=4 2254 B6R0.8 CCS(=N)(=O)CC MCULE-1377380719 [1,1,0,0,0,0|2,0,0]=4 2255 B6R0.8 CCS(=O)(=O)CC MCULE-5339813362 [1,1,0,0,0,0|2,0,0]=4 2256 B6R0.8 CCS(=O)(=O)NC MCULE-6063674993 [1,1,0,0,0,0|2,0,0]=4 2257 B6R0.8 CCS(=O)(=O)OC MCULE-7196280359 [1,1,0,0,0,0|1,0,0]=3 2258 B6R0.8 COP(=O)(C)OC MCULE-7555071260 [1,1,0,0,0,0|1,1,0]=4 2259 B6R0.8 COP(=O)(Cl)OC MCULE-6641992442 [1,1,0,0,0,0|1,1,0]=4 2260 B6R0.8 COP(=O)(O)OC MCULE-4893199912 [1,1,0,0,0,0|1,1,0]=4 2261 B6R0.8 COP(=O)([O-])OC MCULE-8674997571 [1,1,0,0,0,0|1,1,0]=4 2262 B6R0.8 COP(=O)([S-])OC MCULE-9104059418 [1,1,0,0,0,0|1,1,0]=4 2263 B6R0.8 COS(=O)(=O)OC MCULE-2861298645 [1,1,0,0,0,0|1,1,0]=4 2264 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [1,1,0,0,0,0|1,0,0]=3 2265 B6R0.9 C/N=C(\NC)/SC MCULE-5887112308 [1,1,0,0,0,0|2,0,0]=4 2266 B6R0.9 C/N=C(\NC)/SC MCULE-7506115046 [1,1,0,0,0,0|2,0,0]=4 2267 B6R0.9 CC=C(C#N)CC MCULE-7873183675 [1,1,0,0,0,0|2,0,0]=4 2268 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [1,1,0,0,0,0|1,0,0]=3 2269 B6R0.9 CC=C(CC)CC MCULE-5609717261 [1,1,0,0,0,0|2,0,0]=4 2270 B6R0.9 CCB(CC)OC MCULE-5839415433 [1,1,0,0,0,0|2,0,0]=4 2271 B6R0.9 CCC(=CO)CC MCULE-4973169590 [1,1,0,0,0,0|1,0,1]=4 2272 B6R0.9 CCC(=CO)CC MCULE-8459100577 [1,1,0,0,0,0|1,0,1]=4 2273 B6R0.9 CCC(C=O)CC MCULE-3529464122 [1,1,0,0,0,0|1,0,1]=4 2274 B6R0.9 CCC(CBr)OC MCULE-1656817461 [1,1,0,0,0,0|1,0,1]=4 2275 B6R0.9 CCC(CN)OC MCULE-2981477258 [1,1,0,0,0,0|1,0,1]=4 2276 B6R0.9 CCC(CN)OC MCULE-5102774189 [1,1,0,0,0,0|1,0,1]=4 2277 B6R0.9 CCC(CO)OC MCULE-3822452142 [1,1,0,0,0,0|0,0,2]=4 2278 B6R0.9 CCC(OC)OC MCULE-8987892974 [1,1,0,0,0,0|0,0,2]=4 2279 B6R0.9 CCN(C=O)CC MCULE-9053231156 [1,1,0,0,0,0|2,0,0]=4 2280 B6R0.9 CCN(CC)N=O MCULE-8931177297 [1,1,0,0,0,0|2,0,0]=4 2281 B6R0.9 COC(C=O)OC MCULE-7354932286 [1,1,0,0,0,0|0,1,1]=4 2282 B6R0.9 COC(CS)OC MCULE-2408457054 [1,1,0,0,0,0|0,0,2]=4 2283 B8R0.2 C=C(C(=O)OC)C(C)C MCULE-2572436258 [0,2,0,0,0,0|1,0,1]=4 2284 B8R0.2 C=C(C(=O)OC)C(C)O MCULE-5811418696 [0,2,0,0,0,0|1,0,1]=4 2285 B8R0.2 C=C(C)C(Cl)C(=O)OC MCULE-1665283862 [0,2,0,0,0,0|1,0,0]=3 2286 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-5118385991 [0,2,0,0,0,0|1,0,1]=4 2287 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-7419562140 [0,2,0,0,0,0|1,0,1]=4 2288 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-8416732356 [0,2,0,0,0,0|1,0,1]=4 2289 B8R0.2 CCC(Br)C(=O)N(C)C MCULE-4967079536 [0,2,0,0,0,0|2,0,0]=4 2290 B8R0.2 CCC(C)C(=O)C(C)C MCULE-5036699104 [0,2,0,0,0,0|2,0,0]=4 2291 B8R0.2 CCC(N)C(=O)N(C)C MCULE-7436417019 [0,2,0,0,0,0|2,0,0]=4 2292 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-7595904175 [0,2,0,0,0,0|2,0,0]=4 2293 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-8778722434 [0,2,0,0,0,0|2,0,0]=4 2294 B8R0.2 CNC(=O)C(Cl)C(=O)C MCULE-7816149596 [0,2,0,0,0,0|2,0,0]=4 2295 B8R0.2 CNC(=O)C(N)C(C)C MCULE-5039980272 [0,2,0,0,0,0|2,0,0]=4 2296 B8R0.2 CNC(=O)C(N)C(C)C MCULE-6250670183 [0,2,0,0,0,0|2,0,0]=4 2297 B8R0.2 CNC(=O)C(N)C(C)O MCULE-1025476590 [0,2,0,0,0,0|2,0,0]=4 2298 B8R0.2 CNC(=O)C(N)C(C)O MCULE-6101866105 [0,2,0,0,0,0|2,0,0]=4 2299 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-2019787073 [0,2,0,0,0,0|2,0,0]=4 2300 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-4411063508 [0,2,0,0,0,0|2,0,0]=4 2301 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-4541405149 [0,2,0,0,0,0|2,0,0]=4 2302 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-6209151629 [0,2,0,0,0,0|2,0,0]=4 2303 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-1326924990 [0,2,0,0,0,0|2,0,0]=4 2304 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-5094760218 [0,2,0,0,0,0|2,0,0]=4 2305 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-9454209271 [0,2,0,0,0,0|2,0,0]=4 2306 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-9558878758 [0,2,0,0,0,0|2,0,0]=4 2307 B8R0.2 CNC(C)C(=O)N(C)C MCULE-8857921885 [0,2,0,0,0,0|2,0,0]=4 2308 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-5765231303 [0,2,0,0,0,0|2,0,0]=4 2309 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-9148770350 [0,2,0,0,0,0|2,0,0]=4 2310 B8R0.2 COC(=O)C(=C(C)C)Br MCULE-8636120575 [0,2,0,0,0,0|1,0,1]=4 2311 B8R0.2 COC(=O)C(=O)C(C)Br MCULE-1006616025 [0,2,0,0,0,0|1,0,1]=4 2312 B8R0.2 COC(=O)C(=O)C(C)C MCULE-5411002089 [0,2,0,0,0,0|1,0,1]=4 2313 B8R0.2 COC(=O)C(=O)C(C)Cl MCULE-1746484890 [0,2,0,0,0,0|1,0,1]=4 2314 B8R0.2 COC(=O)C(=O)N(C)C MCULE-3358727731 [0,2,0,0,0,0|1,0,1]=4 2315 B8R0.2 COC(=O)C(Br)C(=O)C MCULE-4571030586 [0,2,0,0,0,0|1,0,0]=3 2316 B8R0.2 COC(=O)C(Br)C(C)Br MCULE-1209772107 [0,2,0,0,0,0|1,0,0]=3 2317 B8R0.2 COC(=O)C(Br)C(C)C MCULE-2879214598 [0,2,0,0,0,0|1,0,0]=3 2318 B8R0.2 COC(=O)C(C)C(=O)C MCULE-7473005493 [0,2,0,0,0,0|1,0,0]=3 2319 B8R0.2 COC(=O)C(C)C(=O)N MCULE-7480268767 [0,2,0,0,0,0|2,0,0]=4 2320 B8R0.2 COC(=O)C(C)C(=O)O MCULE-6548116408 [0,2,0,0,0,0|2,0,0]=4 2321 B8R0.2 COC(=O)C(C)C(C)O MCULE-1377857651 [0,2,0,0,0,0|1,0,0]=3 2322 B8R0.2 COC(=O)C(C)C(C)S MCULE-8090305970 [0,2,0,0,0,0|1,0,0]=3 2323 B8R0.2 COC(=O)C(C)N(=O)=O MCULE-1508014455 [0,2,0,0,0,0|2,0,0]=4 2324 B8R0.2 COC(=O)C(Cl)C(=O)C MCULE-8703201551 [0,2,0,0,0,0|1,0,0]=3 2325 B8R0.2 COC(=O)C(Cl)C(C)Cl MCULE-8079111955 [0,2,0,0,0,0|1,0,0]=3 2326 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6003738013 [0,2,0,0,0,0|1,0,0]=3 2327 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6286319401 [0,2,0,0,0,0|1,0,0]=3 2328 B8R0.2 COC(=O)C(N)C(=O)O MCULE-2696171130 [0,2,0,0,0,0|2,0,0]=4 2329 B8R0.2 COC(=O)C(N)C(=O)O MCULE-7192453479 [0,2,0,0,0,0|2,0,0]=4 2330 B8R0.2 COC(=O)C(N)C(C)C MCULE-2054930909 [0,2,0,0,0,0|1,0,0]=3 2331 B8R0.2 COC(=O)C(N)C(C)C MCULE-2312805449 [0,2,0,0,0,0|1,0,0]=3 2332 B8R0.2 COC(=O)C(N)C(C)C MCULE-4433456538 [0,2,0,0,0,0|1,0,0]=3 2333 B8R0.2 COC(=O)C(N)C(C)C MCULE-4595803138 [0,2,0,0,0,0|1,0,0]=3 2334 B8R0.2 COC(=O)C(N)C(C)Cl MCULE-6074076208 [0,2,0,0,0,0|1,0,0]=3 2335 B8R0.2 COC(=O)C(N)C(C)Cl MCULE-6154308704 [0,2,0,0,0,0|1,0,0]=3 2336 B8R0.2 COC(=O)C(N)C(C)O MCULE-4054504482 [0,2,0,0,0,0|1,0,0]=3 2337 B8R0.2 COC(=O)C(N)C(C)O MCULE-5137175004 [0,2,0,0,0,0|1,0,0]=3 2338 B8R0.2 COC(=O)C(O)C(C)Br MCULE-7007726043 [0,2,0,0,0,0|1,0,0]=3 2339 B8R0.2 COC(=O)C(O)C(C)C MCULE-8424293497 [0,2,0,0,0,0|1,0,0]=3 2340 B8R0.2 COC(=O)C(O)C(C)N MCULE-7579168292 [0,2,0,0,0,0|1,0,0]=3 2341 B8R0.2 COC(=O)C(S)C(C)C MCULE-4177105598 [0,2,0,0,0,0|1,0,0]=3 2342 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-3813999303 [0,2,0,0,0,0|2,0,0]=4 2343 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-7475117362 [0,2,0,0,0,0|2,0,0]=4 2344 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-1961120276 [0,2,0,0,0,0|1,0,0]=3 2345 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-7694873432 [0,2,0,0,0,0|1,0,0]=3 2346 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-9509659105 [0,2,0,0,0,0|1,0,0]=3 2347 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-9828778245 [0,2,0,0,0,0|1,0,0]=3 2348 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-3396042563 [0,2,0,0,0,0|1,0,0]=3 2349 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-3984373535 [0,2,0,0,0,0|1,0,0]=3 2350 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-5105961994 [0,2,0,0,0,0|1,0,0]=3 2351 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-6341068916 [0,2,0,0,0,0|1,0,0]=3 2352 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-6365007520 [0,2,0,0,0,0|1,0,0]=3 2353 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-9648470447 [0,2,0,0,0,0|1,0,0]=3 2354 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-1344493357 [0,2,0,0,0,0|1,0,0]=3 2355 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-2707639795 [0,2,0,0,0,0|1,0,0]=3 2356 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-5310976879 [0,2,0,0,0,0|1,0,0]=3 2357 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-5466279343 [0,2,0,0,0,0|1,0,0]=3 2358 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-7651050243 [0,2,0,0,0,0|1,0,0]=3 2359 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-9066216802 [0,2,0,0,0,0|1,0,0]=3 2360 B8R0.2 COC(=O)[C@@H](O)C(C)C MCULE-5130677971 [0,2,0,0,0,0|1,0,0]=3 2361 B8R0.2 COC(=O)[C@@H](O)C(C)C MCULE-7282119938 [0,2,0,0,0,0|1,0,0]=3 2362 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-1711341812 [0,2,0,0,0,0|1,0,0]=3 2363 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-1867656873 [0,2,0,0,0,0|1,0,0]=3 2364 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-3450004076 [0,2,0,0,0,0|1,0,0]=3 2365 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-7295638242 [0,2,0,0,0,0|1,0,0]=3 2366 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-2129476798 [0,2,0,0,0,0|1,0,0]=3 2367 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-5614881016 [0,2,0,0,0,0|1,0,0]=3 2368 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-5653129894 [0,2,0,0,0,0|1,0,0]=3 2369 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-7878824190 [0,2,0,0,0,0|1,0,0]=3 2370 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-5915481519 [0,2,0,0,0,0|1,0,0]=3 2371 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-6143392922 [0,2,0,0,0,0|1,0,0]=3 2372 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-8582390480 [0,2,0,0,0,0|1,0,0]=3 2373 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-8654293763 [0,2,0,0,0,0|1,0,0]=3 2374 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-1159030229 [0,2,0,0,0,0|1,0,0]=3 2375 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-3519054990 [0,2,0,0,0,0|1,0,0]=3 2376 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-9015310634 [0,2,0,0,0,0|1,0,0]=3 2377 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-9519182030 [0,2,0,0,0,0|1,0,0]=3 2378 B8R0.2 COC(=O)[C@H](O)C(C)C MCULE-2046755935 [0,2,0,0,0,0|1,0,0]=3 2379 B8R0.2 COC(=O)[C@H](O)C(C)C MCULE-7450255928 [0,2,0,0,0,0|1,0,0]=3 2380 B8R0.5 C/C=C/C(=O)OC(C)C MCULE-1616974622 [0,2,0,0,0,0|1,0,1]=4 2381 B8R0.5 C=C(Br)CC(=O)OCC MCULE-2786450044 [0,2,0,0,0,0|1,0,1]=4 2382 B8R0.5 CC(C)CC(=O)OCCl MCULE-3506308902 [0,2,0,0,0,0|1,0,0]=3 2383 B8R0.5 CC(C)CC(=O)OCI MCULE-8217025108 [0,2,0,0,0,0|1,0,0]=3 2384 B8R0.5 CC(C)NC(=O)OCCl MCULE-9464097550 [0,2,0,0,0,0|2,0,0]=4 2385 B8R0.5 CC(C)OC(=O)CC#N MCULE-7936509362 [0,2,0,0,0,0|2,0,0]=4 2386 B8R0.5 CC(C)OC(=O)CCBr MCULE-2382797929 [0,2,0,0,0,0|2,0,0]=4 2387 B8R0.5 CC(C)OC(=O)CCCl MCULE-7655932888 [0,2,0,0,0,0|2,0,0]=4 2388 B8R0.5 CC(C)OC(=O)CCN MCULE-8590072190 [0,2,0,0,0,0|2,0,0]=4 2389 B8R0.5 CC(C)OC(=O)CCS MCULE-6681403441 [0,2,0,0,0,0|2,0,0]=4 2390 B8R0.5 CC(C)OC(=O)OCCl MCULE-6987085424 [0,2,0,0,0,0|2,0,0]=4 2391 B8R0.5 CC(C)OC(=O)OCI MCULE-7199284723 [0,2,0,0,0,0|2,0,0]=4 2392 B8R0.5 CC=CC(=O)OC(C)C MCULE-1964573167 [0,2,0,0,0,0|1,0,1]=4 2393 B8R0.5 CCCC(=O)CC(=O)C MCULE-1126963023 [0,2,0,0,0,0|2,0,0]=4 2394 B8R0.5 CCCC(=O)CC(C)C MCULE-1475988710 [0,2,0,0,0,0|2,0,0]=4 2395 B8R0.5 CCCC(=O)NC(C)C MCULE-1125409776 [0,2,0,0,0,0|2,0,0]=4 2396 B8R0.5 CCCC(=O)OC(C)C MCULE-1932528429 [0,2,0,0,0,0|1,0,0]=3 2397 B8R0.5 CCNC(=O)CC(C)O MCULE-1959743741 [0,2,0,0,0,0|2,0,0]=4 2398 B8R0.5 CCOC(=N)CC(C)C MCULE-4196552764 [0,2,0,0,0,0|2,0,0]=4 2399 B8R0.5 CCOC(=N)CC(C)C MCULE-7556709104 [0,2,0,0,0,0|2,0,0]=4 2400 B8R0.5 CCOC(=O)/C=C(/C)\I MCULE-5085340581 [0,2,0,0,0,0|1,0,1]=4 2401 B8R0.5 CCOC(=O)/C=C(/C)\N MCULE-2741839757 [0,2,0,0,0,0|1,0,1]=4 2402 B8R0.5 CCOC(=O)/C=C(/C)\[O-] MCULE-8926472469 [0,2,0,0,0,0|1,0,1]=4 2403 B8R0.5 CCOC(=O)/C=C(/C)\[O-] MCULE-9996122453 [0,2,0,0,0,0|1,0,1]=4 2404 B8R0.5 CCOC(=O)/C=C(\C)/N MCULE-2531351299 [0,2,0,0,0,0|1,0,1]=4 2405 B8R0.5 CCOC(=O)C=C(C)C MCULE-2935651341 [0,2,0,0,0,0|1,0,1]=4 2406 B8R0.5 CCOC(=O)C=C(C)I MCULE-4319141798 [0,2,0,0,0,0|1,0,1]=4 2407 B8R0.5 CCOC(=O)C=C(C)N MCULE-5559390637 [0,2,0,0,0,0|1,0,1]=4 2408 B8R0.5 CCOC(=O)CC(=N)N MCULE-2205626178 [0,2,0,0,0,0|2,0,0]=4 2409 B8R0.5 CCOC(=O)CC(=N)N MCULE-7102889149 [0,2,0,0,0,0|2,0,0]=4 2410 B8R0.5 CCOC(=O)CC(=O)C MCULE-8615117086 [0,2,0,0,0,0|1,0,0]=3 2411 B8R0.5 CCOC(=O)CC(=O)Cl MCULE-2946486230 [0,2,0,0,0,0|2,0,0]=4 2412 B8R0.5 CCOC(=O)CC(=O)N MCULE-7799038725 [0,2,0,0,0,0|2,0,0]=4 2413 B8R0.5 CCOC(=O)CC(=O)O MCULE-9495505919 [0,2,0,0,0,0|2,0,0]=4 2414 B8R0.5 CCOC(=O)CC(=O)[O-] MCULE-6229774103 [0,2,0,0,0,0|2,0,0]=4 2415 B8R0.5 CCOC(=O)CC(=S)N MCULE-8264583697 [0,2,0,0,0,0|2,0,0]=4 2416 B8R0.5 CCOC(=O)CC(C)Br MCULE-4224246188 [0,2,0,0,0,0|1,0,0]=3 2417 B8R0.5 CCOC(=O)CC(C)C MCULE-1409113611 [0,2,0,0,0,0|1,0,0]=3 2418 B8R0.5 CCOC(=O)CC(C)N MCULE-1243805331 [0,2,0,0,0,0|1,0,0]=3 2419 B8R0.5 CCOC(=O)CC(C)N MCULE-5115744093 [0,2,0,0,0,0|1,0,0]=3 2420 B8R0.5 CCOC(=O)CC(C)N MCULE-5865270424 [0,2,0,0,0,0|1,0,0]=3 2421 B8R0.5 CCOC(=O)CC(C)N MCULE-7563274819 [0,2,0,0,0,0|1,0,0]=3 2422 B8R0.5 CCOC(=O)CC(C)O MCULE-5738582973 [0,2,0,0,0,0|1,0,0]=3 2423 B8R0.5 CCOC(=O)CC(C)O MCULE-7412227285 [0,2,0,0,0,0|1,0,0]=3 2424 B8R0.5 CCOC(=O)CC(C)S MCULE-1321603394 [0,2,0,0,0,0|1,0,0]=3 2425 B8R0.5 CCOC(=O)CC(F)F MCULE-9099238197 [0,2,0,0,0,0|2,0,0]=4 2426 B8R0.5 CCOC(=O)CN(=O)=O MCULE-2325981285 [0,2,0,0,0,0|2,0,0]=4 2427 B8R0.5 CCOC(=O)CN(C)C MCULE-7481726803 [0,2,0,0,0,0|1,0,0]=3 2428 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-1945272442 [0,2,0,0,0,0|1,0,0]=3 2429 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-2760267862 [0,2,0,0,0,0|1,0,0]=3 2430 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-3046196442 [0,2,0,0,0,0|1,0,0]=3 2431 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-8919184785 [0,2,0,0,0,0|1,0,0]=3 2432 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-2482059514 [0,2,0,0,0,0|1,0,0]=3 2433 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-7632639859 [0,2,0,0,0,0|1,0,0]=3 2434 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-2736239635 [0,2,0,0,0,0|1,0,0]=3 2435 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-4857755885 [0,2,0,0,0,0|1,0,0]=3 2436 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-8001518919 [0,2,0,0,0,0|1,0,0]=3 2437 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-9141489226 [0,2,0,0,0,0|1,0,0]=3 2438 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-7934535288 [0,2,0,0,0,0|1,0,0]=3 2439 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-8099928659 [0,2,0,0,0,0|1,0,0]=3 2440 B8R0.5 CCOC(=O)C[S+](C)C MCULE-6931339935 [0,2,0,0,0,0|0,0,1]=3 2441 B8R0.5 CCOC(=O)C[S+](C)C MCULE-7075454926 [0,2,0,0,0,0|0,0,1]=3 2442 B8R0.5 CCOC(=O)NC(=O)C MCULE-8711109897 [0,2,0,0,0,0|2,0,0]=4 2443 B8R0.5 CCOC(=O)NC(C)C MCULE-1540464163 [0,2,0,0,0,0|2,0,0]=4 2444 B8R0.5 CCOC(=O)OC(C)Cl MCULE-6170131499 [0,2,0,0,0,0|2,0,0]=4 2445 B8R0.5 CNCC(=O)NC(C)C MCULE-3564656726 [0,2,0,0,0,0|2,0,0]=4 2446 B8R0.5 CNCC(=O)NC(C)C MCULE-7083002433 [0,2,0,0,0,0|2,0,0]=4 2447 B8R0.5 COCC(=O)CC(=O)C MCULE-8600900987 [0,2,0,0,0,0|1,0,0]=3 2448 B8R0.5 COCC(=O)CC(C)C MCULE-3040467675 [0,2,0,0,0,0|1,0,0]=3 2449 B8R0.5 COCC(=O)OC(C)C MCULE-3543304597 [0,2,0,0,0,0|0,1,0]=3 2450 B8R0.16 CO/C(=C/N(C)C)/C=O MCULE-7624417388 [0,2,0,0,0,0|1,0,1]=4 2451 B8R0.16 COC(=CN(C)C)C=O MCULE-9451220083 [0,2,0,0,0,0|1,0,1]=4 2452 B8R0.16 COC(C=O)CC(C)C MCULE-3050869989 [0,2,0,0,0,0|1,0,1]=4 2453 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [0,2,0,0,0,0|1,0,0]=3 2454 B8R0.19 C=C(C#N)CC(=O)OC MCULE-6170444323 [0,2,0,0,0,0|1,0,1]=4 2455 B8R0.19 C=C(CCl)CC(=O)OC MCULE-3436182948 [0,2,0,0,0,0|1,0,0]=3 2456 B8R0.19 CCC(=O)CC(=O)CC MCULE-9368471361 [0,2,0,0,0,0|2,0,0]=4 2457 B8R0.19 CCC(=O)CC(=O)OC MCULE-1605349915 [0,2,0,0,0,0|1,0,0]=3 2458 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [0,2,0,0,0,0|2,0,0]=4 2459 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [0,2,0,0,0,0|2,0,0]=4 2460 B8R0.19 CCC(C)CC(=O)OC MCULE-6040162942 [0,2,0,0,0,0|1,0,0]=3 2461 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [0,2,0,0,0,0|1,0,0]=3 2462 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [0,2,0,0,0,0|1,0,0]=3 2463 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [0,2,0,0,0,0|1,0,0]=3 2464 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [0,2,0,0,0,0|1,0,0]=3 2465 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [0,2,0,0,0,0|1,0,0]=3 2466 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [0,2,0,0,0,0|1,0,0]=3 2467 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [0,2,0,0,0,0|1,0,0]=3 2468 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [0,2,0,0,0,0|1,0,0]=3 2469 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [0,2,0,0,0,0|1,0,0]=3 2470 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [0,2,0,0,0,0|1,0,0]=3 2471 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [0,2,0,0,0,0|1,0,0]=3 2472 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [0,2,0,0,0,0|1,0,0]=3 2473 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [0,2,0,0,0,0|1,0,0]=3 2474 B8R0.19 CN/C(=C/C(=O)OC)/C MCULE-6748104823 [0,2,0,0,0,0|1,0,1]=4 2475 B8R0.19 CN/C(=C\C(=O)OC)/C MCULE-6583518879 [0,2,0,0,0,0|1,0,1]=4 2476 B8R0.19 CNC(=CC(=O)OC)C MCULE-1607524183 [0,2,0,0,0,0|1,0,1]=4 2477 B8R0.19 CNC(=O)CC(=O)NC MCULE-9228601964 [0,2,0,0,0,0|2,0,0]=4 2478 B8R0.19 CNC(=O)CC(C)NC MCULE-8409395532 [0,2,0,0,0,0|2,0,0]=4 2479 B8R0.19 CNC(=O)CC(C)NC MCULE-9311295772 [0,2,0,0,0,0|2,0,0]=4 2480 B8R0.19 CNC(C)CC(=O)OC MCULE-1039195486 [0,2,0,0,0,0|1,0,0]=3 2481 B8R0.19 COC(=N)CC(=N)OC MCULE-4595570584 [0,2,0,0,0,0|1,1,0]=4 2482 B8R0.19 COC(=N)CC(=N)OC MCULE-4616387451 [0,2,0,0,0,0|1,1,0]=4 2483 B8R0.19 COC(=N)CC(=O)OC MCULE-2416316391 [0,2,0,0,0,0|0,1,0]=3 2484 B8R0.19 COC(=N)CC(=O)OC MCULE-9193442551 [0,2,0,0,0,0|0,1,0]=3 2485 B8R0.19 COC(=O)/C=C(\C)/OC MCULE-8813923973 [0,2,0,0,0,0|0,1,1]=4 2486 B8R0.19 COC(=O)C=C(C)C=O MCULE-8776671343 [0,2,0,0,0,0|1,0,1]=4 2487 B8R0.19 COC(=O)C=C(C)OC MCULE-1610055087 [0,2,0,0,0,0|0,1,1]=4 2488 B8R0.19 COC(=O)C=C(N)CF MCULE-6823347436 [0,2,0,0,0,0|1,0,1]=4 2489 B8R0.19 COC(=O)CC(=O)CCl MCULE-1683633113 [0,2,0,0,0,0|1,0,0]=3 2490 B8R0.19 COC(=O)CC(=O)OC MCULE-1727448163 [0,2,0,0,0,0|0,1,0]=3 2491 B8R0.19 COC(=O)CC(C)C=O MCULE-1183479071 [0,2,0,0,0,0|1,0,0]=3 2492 B8R0.19 COC(=O)CC(C)CBr MCULE-9170421446 [0,2,0,0,0,0|1,0,0]=3 2493 B8R0.19 COC(=O)CC(C)SC MCULE-9425584839 [0,2,0,0,0,0|0,0,0]=2 2494 B8R0.19 COC(=O)CC(N)CN MCULE-3079708048 [0,2,0,0,0,0|1,0,0]=3 2495 B8R0.19 COC(=O)CC(N)CN MCULE-5046271852 [0,2,0,0,0,0|1,0,0]=3 2496 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [0,2,0,0,0,0|1,0,0]=3 2497 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [0,2,0,0,0,0|1,0,0]=3 2498 B8R0.19 COC(=O)CC(O)CCl MCULE-3924993874 [0,2,0,0,0,0|1,0,0]=3 2499 B8R0.19 COC(=O)CC(O)CN MCULE-6633164904 [0,2,0,0,0,0|1,0,0]=3 2500 B8R0.19 COC(=O)CC(O)CN MCULE-6973205945 [0,2,0,0,0,0|1,0,0]=3 2501 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [0,2,0,0,0,0|1,0,0]=3 2502 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [0,2,0,0,0,0|1,0,0]=3 2503 B8R0.19 COC(=O)CN(C)C=O MCULE-9266775990 [0,2,0,0,0,0|1,0,0]=3 2504 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2437500598 [0,2,0,0,0,0|1,0,0]=3 2505 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2535323310 [0,2,0,0,0,0|1,0,0]=3 2506 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2232290900 [0,2,0,0,0,0|1,0,0]=3 2507 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2298624118 [0,2,0,0,0,0|1,0,0]=3 2508 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [0,2,0,0,0,0|1,0,0]=3 2509 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [0,2,0,0,0,0|1,0,0]=3 2510 B8R0.19 COC(=O)NC(=O)CCl MCULE-6558463162 [0,2,0,0,0,0|2,0,0]=4 2511 B8R0.19 COC(=O)NC(C)CN MCULE-4563927308 [0,2,0,0,0,0|2,0,0]=4 2512 B8R0.19 COC(=O)NC(C)CN MCULE-8813177733 [0,2,0,0,0,0|2,0,0]=4 2513 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-1533957902 [0,2,0,0,0,0|2,0,0]=4 2514 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-7036214898 [0,2,0,0,0,0|2,0,0]=4 2515 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-8908212489 [0,2,0,0,0,0|2,0,0]=4 2516 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-9526857370 [0,2,0,0,0,0|2,0,0]=4 2517 B8R0.19 COC(=O)OC(=O)OC MCULE-4144943626 [0,2,0,0,0,0|0,1,1]=4 2518 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [0,2,0,0,0,0|1,0,0]=3 2519 B8R0.23 CC(=O)C(=O)CC(C)C MCULE-9490612135 [0,2,0,0,0,0|2,0,0]=4 2520 B8R0.23 CC(=O)CC(=O)C(C)C MCULE-9885161576 [0,2,0,0,0,0|2,0,0]=4 2521 B8R0.23 CC(=O)CC(=O)N(C)C MCULE-7573334456 [0,2,0,0,0,0|2,0,0]=4 2522 B8R0.23 CC(C)CC(=O)C(C)C MCULE-4667603330 [0,2,0,0,0,0|2,0,0]=4 2523 B8R0.23 CC(C)CC(=O)N(C)C MCULE-4436370176 [0,2,0,0,0,0|2,0,0]=4 2524 B8R0.23 CN(C)CC(=O)N(C)O MCULE-4554994791 [0,2,0,0,0,0|2,0,0]=4 2525 B8R0.23 C[C@H](O)CC(=O)N(C)C MCULE-1249894790 [0,2,0,0,0,0|2,0,0]=4 2526 B8R0.24 CNC(=O)CS(=O)(=O)C MCULE-7688916364 [0,2,0,0,0,0|1,0,1]=4 2527 B8R0.24 COC(=O)CC(C)(C)Br MCULE-8991861071 [0,2,0,0,0,0|1,0,0]=3 2528 B8R0.24 COC(=O)CC(C)(C)C MCULE-3411402706 [0,2,0,0,0,0|1,0,0]=3 2529 B8R0.24 COC(=O)CC(C)(C)N MCULE-1261823146 [0,2,0,0,0,0|1,0,0]=3 2530 B8R0.24 COC(=O)CC(C)(C)N MCULE-9654641564 [0,2,0,0,0,0|1,0,0]=3 2531 B8R0.24 COC(=O)CC(C)(C)O MCULE-7166479769 [0,2,0,0,0,0|1,0,0]=3 2532 B8R0.24 COC(=O)CC(C)(F)F MCULE-7009111440 [0,2,0,0,0,0|1,0,0]=3 2533 B8R0.24 COC(=O)CC(F)(F)F MCULE-6904688197 [0,2,0,0,0,0|2,0,0]=4 2534 B8R0.24 COC(=O)CP(=O)(O)O MCULE-7218551741 [0,2,0,0,0,0|2,0,0]=4 2535 B8R0.24 COC(=O)CS(=O)(=O)C MCULE-8613714610 [0,2,0,0,0,0|0,0,1]=3 2536 B8R0.24 COC(=O)CS(=O)(=O)Cl MCULE-1243995626 [0,2,0,0,0,0|1,0,1]=4 2537 B8R0.24 COC(=O)CS(=O)(=O)F MCULE-7680738509 [0,2,0,0,0,0|1,0,1]=4 2538 B8R0.24 COC(=O)CS(=O)(=O)N MCULE-3798914658 [0,2,0,0,0,0|1,0,1]=4 2539 B8R0.24 COC(=O)CS(=O)(=O)O MCULE-8404555176 [0,2,0,0,0,0|1,0,1]=4 2540 B8R0.24 COC(=O)CS(=O)(=O)[O-] MCULE-1512976061 [0,2,0,0,0,0|1,0,1]=4 2541 B8R0.24 COC(=O)C[Si](C)(C)C MCULE-5804507255 [0,2,0,0,0,0|1,0,0]=3 2542 B8R0.24 COC(=O)NC(C)(C)C MCULE-9651721607 [0,2,0,0,0,0|2,0,0]=4 2543 B8R0.24 COC(=O)N[Si](C)(C)C MCULE-4344729633 [0,2,0,0,0,0|2,0,0]=4 2544 B8R0.24 COC(=O)OC(C)(C)C MCULE-4865384314 [0,2,0,0,0,0|2,0,0]=4 2545 B8R0.1 C#CCCC(=O)OCC MCULE-9456160977 [0,2,0,0,0,0|1,0,1]=4 2546 B8R0.1 C#CCNC(=O)CCC MCULE-4710217959 [0,2,0,0,0,0|2,0,0]=4 2547 B8R0.1 C#CCNC(=O)COC MCULE-4159755429 [0,2,0,0,0,0|1,0,1]=4 2548 B8R0.1 C/C=C/C(=O)CCCC MCULE-6753420308 [0,2,0,0,0,0|2,0,0]=4 2549 B8R0.1 C=CCCC(=O)CCC MCULE-9846709255 [0,2,0,0,0,0|2,0,0]=4 2550 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [0,2,0,0,0,0|1,0,1]=4 2551 B8R0.1 C=CCNC(=O)CNC MCULE-3751200138 [0,2,0,0,0,0|2,0,0]=4 2552 B8R0.1 C=CCNC(=O)CNC MCULE-7358806932 [0,2,0,0,0,0|2,0,0]=4 2553 B8R0.1 C=CCOC(=O)/C=C/C MCULE-8988055269 [0,2,0,0,0,0|1,0,1]=4 2554 B8R0.1 C=CCOC(=O)CC#N MCULE-6302930659 [0,2,0,0,0,0|2,0,0]=4 2555 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [0,2,0,0,0,0|1,0,0]=3 2556 B8R0.1 C=CCOC(=O)OCC MCULE-4897941593 [0,2,0,0,0,0|1,0,1]=4 2557 B8R0.1 CC#CCC(=O)OCC MCULE-3108892964 [0,2,0,0,0,0|1,0,0]=3 2558 B8R0.1 CC/C=C/C(=O)OCC MCULE-6281513551 [0,2,0,0,0,0|1,0,1]=4 2559 B8R0.1 CC=CC(=O)CCCC MCULE-2281679965 [0,2,0,0,0,0|2,0,0]=4 2560 B8R0.1 CCC#CC(=O)OCC MCULE-2785923283 [0,2,0,0,0,0|1,0,1]=4 2561 B8R0.1 CCC=CC(=O)OCC MCULE-2840510617 [0,2,0,0,0,0|1,0,1]=4 2562 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [0,2,0,0,0,0|2,0,0]=4 2563 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [0,2,0,0,0,0|1,0,0]=3 2564 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [0,2,0,0,0,0|1,0,0]=3 2565 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [0,2,0,0,0,0|2,0,0]=4 2566 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [0,2,0,0,0,0|2,0,0]=4 2567 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,2,0,0,0,0|2,0,0]=4 2568 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [0,2,0,0,0,0|1,0,0]=3 2569 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,2,0,0,0,0|1,0,0]=3 2570 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [0,2,0,0,0,0|1,0,0]=3 2571 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [0,2,0,0,0,0|2,0,0]=4 2572 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [0,2,0,0,0,0|2,0,0]=4 2573 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [0,2,0,0,0,0|2,0,0]=4 2574 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [0,2,0,0,0,0|2,0,0]=4 2575 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [0,2,0,0,0,0|2,0,0]=4 2576 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [0,2,0,0,0,0|2,0,0]=4 2577 B8R0.1 CCCOC(=O)CC#N MCULE-6051640060 [0,2,0,0,0,0|2,0,0]=4 2578 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [0,2,0,0,0,0|1,0,0]=3 2579 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [0,2,0,0,0,0|2,0,0]=4 2580 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [0,2,0,0,0,0|2,0,0]=4 2581 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [0,2,0,0,0,0|2,0,0]=4 2582 B8R0.1 CCCOC(=O)OCCl MCULE-7435813375 [0,2,0,0,0,0|1,0,0]=3 2583 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [0,2,0,0,0,0|2,0,0]=4 2584 B8R0.1 CCNCC(=O)OCC MCULE-7972358572 [0,2,0,0,0,0|1,0,0]=3 2585 B8R0.1 CCNCC(=O)OCC MCULE-8893227629 [0,2,0,0,0,0|1,0,0]=3 2586 B8R0.1 CCOC(=N)CCCBr MCULE-1694733128 [0,2,0,0,0,0|2,0,0]=4 2587 B8R0.1 CCOC(=N)CCCBr MCULE-5188406239 [0,2,0,0,0,0|2,0,0]=4 2588 B8R0.1 CCOC(=N)CCCCl MCULE-2912870166 [0,2,0,0,0,0|2,0,0]=4 2589 B8R0.1 CCOC(=N)CCCCl MCULE-6562903266 [0,2,0,0,0,0|2,0,0]=4 2590 B8R0.1 CCOC(=N)CCOC MCULE-8187493489 [0,2,0,0,0,0|1,1,0]=4 2591 B8R0.1 CCOC(=N)CCOC MCULE-9185956666 [0,2,0,0,0,0|1,1,0]=4 2592 B8R0.1 CCOC(=O)/C=C/CBr MCULE-5352661836 [0,2,0,0,0,0|1,0,1]=4 2593 B8R0.1 CCOC(=O)/C=C/CO MCULE-7879343808 [0,2,0,0,0,0|1,0,1]=4 2594 B8R0.1 CCOC(=O)/C=N/NC MCULE-1711872477 [0,2,0,0,0,0|1,0,1]=4 2595 B8R0.1 CCOC(=O)/C=N/OC MCULE-3959533877 [0,2,0,0,0,0|0,1,1]=4 2596 B8R0.1 CCOC(=O)C#CCO MCULE-5094094961 [0,2,0,0,0,0|1,0,1]=4 2597 B8R0.1 CCOC(=O)C=CCBr MCULE-6455444227 [0,2,0,0,0,0|1,0,1]=4 2598 B8R0.1 CCOC(=O)C=CCCl MCULE-7995326623 [0,2,0,0,0,0|1,0,1]=4 2599 B8R0.1 CCOC(=O)C=CCN MCULE-4129018658 [0,2,0,0,0,0|1,0,1]=4 2600 B8R0.1 CCOC(=O)C=CCN MCULE-5635501690 [0,2,0,0,0,0|1,0,1]=4 2601 B8R0.1 CCOC(=O)C=CCN MCULE-9641729290 [0,2,0,0,0,0|1,0,1]=4 2602 B8R0.1 CCOC(=O)C=CCO MCULE-7710620250 [0,2,0,0,0,0|1,0,1]=4 2603 B8R0.1 CCOC(=O)CCC#N MCULE-9221721525 [0,2,0,0,0,0|1,0,1]=4 2604 B8R0.1 CCOC(=O)CCC=O MCULE-2891201608 [0,2,0,0,0,0|1,0,1]=4 2605 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [0,2,0,0,0,0|1,0,0]=3 2606 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [0,2,0,0,0,0|1,0,0]=3 2607 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [0,2,0,0,0,0|1,0,0]=3 2608 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [0,2,0,0,0,0|1,0,0]=3 2609 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [0,2,0,0,0,0|1,0,0]=3 2610 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [0,2,0,0,0,0|1,0,0]=3 2611 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [0,2,0,0,0,0|1,0,0]=3 2612 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [0,2,0,0,0,0|1,0,0]=3 2613 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [0,2,0,0,0,0|1,0,0]=3 2614 B8R0.1 CCOC(=O)CCNN MCULE-6880821012 [0,2,0,0,0,0|2,0,0]=4 2615 B8R0.1 CCOC(=O)CCNN MCULE-9638408107 [0,2,0,0,0,0|2,0,0]=4 2616 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [0,2,0,0,0,0|0,1,0]=3 2617 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [0,2,0,0,0,0|0,0,0]=2 2618 B8R0.1 CCOC(=O)CN=C=O MCULE-3309838122 [0,2,0,0,0,0|1,0,1]=4 2619 B8R0.1 CCOC(=O)CN=C=S MCULE-5376687416 [0,2,0,0,0,0|1,0,1]=4 2620 B8R0.1 CCOC(=O)CN=N#N MCULE-1525622937 [0,2,0,0,0,0|2,0,0]=4 2621 B8R0.1 CCOC(=O)CNC=O MCULE-7904243111 [0,2,0,0,0,0|1,0,1]=4 2622 B8R0.1 CCOC(=O)CSC#N MCULE-2930248382 [0,2,0,0,0,0|0,0,1]=3 2623 B8R0.1 CCOC(=O)CSCC MCULE-5930366300 [0,2,0,0,0,0|0,0,0]=2 2624 B8R0.1 CCOC(=O)NCC#N MCULE-3639279920 [0,2,0,0,0,0|2,0,0]=4 2625 B8R0.1 CCOC(=O)NCCBr MCULE-4386850032 [0,2,0,0,0,0|2,0,0]=4 2626 B8R0.1 CCOC(=O)NCCCl MCULE-5545666176 [0,2,0,0,0,0|2,0,0]=4 2627 B8R0.1 CCOC(=O)NCCN MCULE-1497223307 [0,2,0,0,0,0|2,0,0]=4 2628 B8R0.1 CCOC(=O)NCCN MCULE-3733943315 [0,2,0,0,0,0|2,0,0]=4 2629 B8R0.1 CCOC(=O)NCCO MCULE-7625780069 [0,2,0,0,0,0|2,0,0]=4 2630 B8R0.1 CCOC(=O)OCCBr MCULE-4627499799 [0,2,0,0,0,0|2,0,0]=4 2631 B8R0.1 CCOCC(=O)OCC MCULE-5439289896 [0,2,0,0,0,0|0,1,0]=3 2632 B8R0.1 CNCC(=O)NCCO MCULE-3176678829 [0,2,0,0,0,0|2,0,0]=4 2633 B8R0.1 CNCC(=O)NCCO MCULE-6959810810 [0,2,0,0,0,0|2,0,0]=4 2634 B8R0.1 COCC(=O)NCCN MCULE-2273634996 [0,2,0,0,0,0|1,1,0]=4 2635 B8R0.1 COCC(=O)NCCO MCULE-3232862916 [0,2,0,0,0,0|1,1,0]=4 2636 B8R0.1 COCCC(=O)CC#N MCULE-3904176449 [0,2,0,0,0,0|2,0,0]=4 2637 B8R0.1 COCCC(=O)COC MCULE-3111860636 [0,2,0,0,0,0|0,1,0]=3 2638 B8R0.1 O=C(CCS)OCCO MCULE-8554625892 [0,2,0,0,0,0|2,0,0]=4 2639 B8R0.3 C#CC(O)C(=O)OCC MCULE-8771410618 [0,2,0,0,0,0|1,0,1]=4 2640 B8R0.3 C#CCC(C)C(=O)OC MCULE-6858702149 [0,2,0,0,0,0|1,0,1]=4 2641 B8R0.3 C#CCC(N)C(=O)OC MCULE-2178950640 [0,2,0,0,0,0|1,0,1]=4 2642 B8R0.3 C#CCC(N)C(=O)OC MCULE-6758978147 [0,2,0,0,0,0|1,0,1]=4 2643 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-1974908886 [0,2,0,0,0,0|1,0,1]=4 2644 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-4511622416 [0,2,0,0,0,0|1,0,1]=4 2645 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-1519824425 [0,2,0,0,0,0|1,0,1]=4 2646 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-2744971317 [0,2,0,0,0,0|1,0,1]=4 2647 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-4813964115 [0,2,0,0,0,0|1,0,1]=4 2648 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-6433911913 [0,2,0,0,0,0|1,0,1]=4 2649 B8R0.3 C/C=C(\C)/C(=O)OCC MCULE-1104279471 [0,2,0,0,0,0|1,0,1]=4 2650 B8R0.3 C/C=C/C(=O)C(C)CC MCULE-6778188943 [0,2,0,0,0,0|2,0,0]=4 2651 B8R0.3 C=C(CC)C(=O)OCC MCULE-9081813283 [0,2,0,0,0,0|1,0,1]=4 2652 B8R0.3 C=C(COC)C(=O)OC MCULE-7593559443 [0,2,0,0,0,0|0,1,0]=3 2653 B8R0.3 C=CC(C)C(=O)OCC MCULE-4071009556 [0,2,0,0,0,0|1,0,1]=4 2654 B8R0.3 C=CC(O)C(=O)OCC MCULE-6322032023 [0,2,0,0,0,0|1,0,1]=4 2655 B8R0.3 C=CCC(Cl)C(=O)OC MCULE-6530091518 [0,2,0,0,0,0|1,0,1]=4 2656 B8R0.3 C=CCC(N)C(=O)OC MCULE-1390503391 [0,2,0,0,0,0|1,0,1]=4 2657 B8R0.3 C=CCC(N)C(=O)OC MCULE-6527008669 [0,2,0,0,0,0|1,0,1]=4 2658 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1188632168 [0,2,0,0,0,0|1,0,1]=4 2659 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1561172370 [0,2,0,0,0,0|1,0,1]=4 2660 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1592773442 [0,2,0,0,0,0|1,0,1]=4 2661 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-2928833845 [0,2,0,0,0,0|1,0,1]=4 2662 B8R0.3 C=CC[C@@H](O)C(=O)OC MCULE-5528424936 [0,2,0,0,0,0|1,0,1]=4 2663 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-1184647267 [0,2,0,0,0,0|1,0,1]=4 2664 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-6782970786 [0,2,0,0,0,0|1,0,1]=4 2665 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-7213365607 [0,2,0,0,0,0|1,0,1]=4 2666 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-9811834405 [0,2,0,0,0,0|1,0,1]=4 2667 B8R0.3 CC=C(C)C(=O)OCC MCULE-1202888826 [0,2,0,0,0,0|1,0,1]=4 2668 B8R0.3 CC=CC(=O)C(C)CC MCULE-2922799117 [0,2,0,0,0,0|2,0,0]=4 2669 B8R0.3 CCC(C)C(=O)OCCl MCULE-6202928203 [0,2,0,0,0,0|1,0,0]=3 2670 B8R0.3 CCC=C(C)C(=O)OC MCULE-1695208139 [0,2,0,0,0,0|1,0,1]=4 2671 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [0,2,0,0,0,0|1,0,0]=3 2672 B8R0.3 CCCC(=O)C(Br)CC MCULE-6260182699 [0,2,0,0,0,0|2,0,0]=4 2673 B8R0.3 CCCC(=O)C(C)CC MCULE-7559638932 [0,2,0,0,0,0|2,0,0]=4 2674 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [0,2,0,0,0,0|2,0,0]=4 2675 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [0,2,0,0,0,0|2,0,0]=4 2676 B8R0.3 CCCC(=O)N(C)OC MCULE-7871714953 [0,2,0,0,0,0|1,0,0]=3 2677 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [0,2,0,0,0,0|1,0,0]=3 2678 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,2,0,0,0,0|2,0,0]=4 2679 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [0,2,0,0,0,0|1,0,0]=3 2680 B8R0.3 CCCC(N)C(=O)NC MCULE-3980097421 [0,2,0,0,0,0|2,0,0]=4 2681 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [0,2,0,0,0,0|1,0,0]=3 2682 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [0,2,0,0,0,0|1,0,0]=3 2683 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [0,2,0,0,0,0|1,0,0]=3 2684 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [0,2,0,0,0,0|1,0,0]=3 2685 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [0,2,0,0,0,0|1,0,0]=3 2686 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [0,2,0,0,0,0|1,0,0]=3 2687 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [0,2,0,0,0,0|1,0,0]=3 2688 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [0,2,0,0,0,0|1,0,0]=3 2689 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [0,2,0,0,0,0|1,0,0]=3 2690 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [0,2,0,0,0,0|1,0,0]=3 2691 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [0,2,0,0,0,0|1,0,0]=3 2692 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [0,2,0,0,0,0|1,0,0]=3 2693 B8R0.3 CCNC(=O)C(N)CC MCULE-2664739052 [0,2,0,0,0,0|2,0,0]=4 2694 B8R0.3 CCNC(=O)[C@@H](N)CC MCULE-2776960278 [0,2,0,0,0,0|2,0,0]=4 2695 B8R0.3 CCNC(=O)[C@@H](N)CC MCULE-4327862853 [0,2,0,0,0,0|2,0,0]=4 2696 B8R0.3 CCNC(C)C(=O)OC MCULE-3289750233 [0,2,0,0,0,0|1,0,0]=3 2697 B8R0.3 CCNC(C)C(=O)OC MCULE-6862987622 [0,2,0,0,0,0|1,0,0]=3 2698 B8R0.3 CCN[C@@H](C)C(=O)OC MCULE-5663920756 [0,2,0,0,0,0|1,0,0]=3 2699 B8R0.3 CCOC(=O)C(=N)SC MCULE-1399563180 [0,2,0,0,0,0|0,0,1]=3 2700 B8R0.3 CCOC(=O)C(=NC)Cl MCULE-1326218878 [0,2,0,0,0,0|1,0,1]=4 2701 B8R0.3 CCOC(=O)C(=O)CC MCULE-6268795804 [0,2,0,0,0,0|1,0,1]=4 2702 B8R0.3 CCOC(=O)C(=O)NC MCULE-7000353340 [0,2,0,0,0,0|1,0,1]=4 2703 B8R0.3 CCOC(=O)C(Br)C#N MCULE-9930540852 [0,2,0,0,0,0|2,0,0]=4 2704 B8R0.3 CCOC(=O)C(Br)CBr MCULE-3811489890 [0,2,0,0,0,0|2,0,0]=4 2705 B8R0.3 CCOC(=O)C(Br)CC MCULE-2467634064 [0,2,0,0,0,0|1,0,0]=3 2706 B8R0.3 CCOC(=O)C(C)C#N MCULE-8318656227 [0,2,0,0,0,0|2,0,0]=4 2707 B8R0.3 CCOC(=O)C(C)C=O MCULE-9226849500 [0,2,0,0,0,0|2,0,0]=4 2708 B8R0.3 CCOC(=O)C(C)CBr MCULE-9513285816 [0,2,0,0,0,0|2,0,0]=4 2709 B8R0.3 CCOC(=O)C(C)CC MCULE-3895639860 [0,2,0,0,0,0|1,0,0]=3 2710 B8R0.3 CCOC(=O)C(C)CCl MCULE-9783842448 [0,2,0,0,0,0|2,0,0]=4 2711 B8R0.3 CCOC(=O)C(C)CN MCULE-6123639141 [0,2,0,0,0,0|2,0,0]=4 2712 B8R0.3 CCOC(=O)C(C)CN MCULE-6716626093 [0,2,0,0,0,0|2,0,0]=4 2713 B8R0.3 CCOC(=O)C(C)CO MCULE-7936560025 [0,2,0,0,0,0|2,0,0]=4 2714 B8R0.3 CCOC(=O)C(C)NC MCULE-3023497472 [0,2,0,0,0,0|1,0,0]=3 2715 B8R0.3 CCOC(=O)C(C)SC MCULE-5858818190 [0,2,0,0,0,0|0,0,0]=2 2716 B8R0.3 CCOC(=O)C(Cl)C=O MCULE-7751421571 [0,2,0,0,0,0|2,0,0]=4 2717 B8R0.3 CCOC(=O)C(Cl)CCl MCULE-3086938360 [0,2,0,0,0,0|2,0,0]=4 2718 B8R0.3 CCOC(=O)C(Cl)SC MCULE-3290320839 [0,2,0,0,0,0|0,0,0]=2 2719 B8R0.3 CCOC(=O)C(N)C#N MCULE-3893668766 [0,2,0,0,0,0|2,0,0]=4 2720 B8R0.3 CCOC(=O)C(N)C#N MCULE-4201771605 [0,2,0,0,0,0|2,0,0]=4 2721 B8R0.3 CCOC(=O)C(N)C#N MCULE-5860664428 [0,2,0,0,0,0|2,0,0]=4 2722 B8R0.3 CCOC(=O)C(N)C#N MCULE-5957058937 [0,2,0,0,0,0|2,0,0]=4 2723 B8R0.3 CCOC(=O)C(N)C#N MCULE-6898947047 [0,2,0,0,0,0|2,0,0]=4 2724 B8R0.3 CCOC(=O)C(N)CC MCULE-1078770122 [0,2,0,0,0,0|1,0,0]=3 2725 B8R0.3 CCOC(=O)C(N)CC MCULE-4005480919 [0,2,0,0,0,0|1,0,0]=3 2726 B8R0.3 CCOC(=O)C(N)CC MCULE-7008098270 [0,2,0,0,0,0|1,0,0]=3 2727 B8R0.3 CCOC(=O)C(N)CC MCULE-9698514597 [0,2,0,0,0,0|1,0,0]=3 2728 B8R0.3 CCOC(=O)C(N)CO MCULE-1666659750 [0,2,0,0,0,0|2,0,0]=4 2729 B8R0.3 CCOC(=O)C(N)CO MCULE-1998512614 [0,2,0,0,0,0|2,0,0]=4 2730 B8R0.3 CCOC(=O)C(N)CO MCULE-2382743439 [0,2,0,0,0,0|2,0,0]=4 2731 B8R0.3 CCOC(=O)C(N)CO MCULE-8735565522 [0,2,0,0,0,0|2,0,0]=4 2732 B8R0.3 CCOC(=O)C(N)CS MCULE-1346857927 [0,2,0,0,0,0|2,0,0]=4 2733 B8R0.3 CCOC(=O)C(N)CS MCULE-2778317647 [0,2,0,0,0,0|2,0,0]=4 2734 B8R0.3 CCOC(=O)C(N)CS MCULE-4631330176 [0,2,0,0,0,0|2,0,0]=4 2735 B8R0.3 CCOC(=O)C(N)CS MCULE-9332095158 [0,2,0,0,0,0|2,0,0]=4 2736 B8R0.3 CCOC(=O)C(O)CC MCULE-7418568069 [0,2,0,0,0,0|1,0,0]=3 2737 B8R0.3 CCOC(=O)C(S)CC MCULE-8709451175 [0,2,0,0,0,0|1,0,0]=3 2738 B8R0.3 CCOC(=O)C([Na])C=O MCULE-2917644984 [0,2,0,0,0,0|2,0,0]=4 2739 B8R0.3 CCOC(=O)N(C)CC MCULE-7562822763 [0,2,0,0,0,0|2,0,0]=4 2740 B8R0.3 CCOC(=O)N(C)OC MCULE-2061988934 [0,2,0,0,0,0|1,1,0]=4 2741 B8R0.3 CCOC(=O)[C@@H](C)OC MCULE-6015342828 [0,2,0,0,0,0|0,1,0]=3 2742 B8R0.3 CCOC(=O)[C@@H](C)OC MCULE-9016823576 [0,2,0,0,0,0|0,1,0]=3 2743 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-3295720196 [0,2,0,0,0,0|1,0,0]=3 2744 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-3974992068 [0,2,0,0,0,0|1,0,0]=3 2745 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-6812206052 [0,2,0,0,0,0|1,0,0]=3 2746 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-7278573962 [0,2,0,0,0,0|1,0,0]=3 2747 B8R0.3 CCOC(=O)[C@@H](N)CN MCULE-3992415653 [0,2,0,0,0,0|2,0,0]=4 2748 B8R0.3 CCOC(=O)[C@@H](N)CN MCULE-5633443221 [0,2,0,0,0,0|2,0,0]=4 2749 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-3922789205 [0,2,0,0,0,0|2,0,0]=4 2750 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-4123182744 [0,2,0,0,0,0|2,0,0]=4 2751 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-9348155020 [0,2,0,0,0,0|2,0,0]=4 2752 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-4155299626 [0,2,0,0,0,0|2,0,0]=4 2753 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-5221844279 [0,2,0,0,0,0|2,0,0]=4 2754 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-7483061356 [0,2,0,0,0,0|2,0,0]=4 2755 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-9958458010 [0,2,0,0,0,0|2,0,0]=4 2756 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-5702747043 [0,2,0,0,0,0|1,0,0]=3 2757 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-6151562245 [0,2,0,0,0,0|1,0,0]=3 2758 B8R0.3 CCOC(=O)[C@H](C)NC MCULE-1179895928 [0,2,0,0,0,0|1,0,0]=3 2759 B8R0.3 CCOC(=O)[C@H](C)NC MCULE-6687011613 [0,2,0,0,0,0|1,0,0]=3 2760 B8R0.3 CCOC(=O)[C@H](N)CC MCULE-6501312525 [0,2,0,0,0,0|1,0,0]=3 2761 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-5633972344 [0,2,0,0,0,0|2,0,0]=4 2762 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-6411527516 [0,2,0,0,0,0|2,0,0]=4 2763 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9780267969 [0,2,0,0,0,0|2,0,0]=4 2764 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9929488925 [0,2,0,0,0,0|2,0,0]=4 2765 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-3111652654 [0,2,0,0,0,0|2,0,0]=4 2766 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-5156842229 [0,2,0,0,0,0|2,0,0]=4 2767 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-7914546483 [0,2,0,0,0,0|2,0,0]=4 2768 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-8471951192 [0,2,0,0,0,0|2,0,0]=4 2769 B8R0.3 CCOC(=O)[C@H](O)CC MCULE-8200594440 [0,2,0,0,0,0|1,0,0]=3 2770 B8R0.3 CNCC(Br)C(=O)OC MCULE-2818400613 [0,2,0,0,0,0|1,0,0]=3 2771 B8R0.3 CNCC(Br)C(=O)OC MCULE-5823314810 [0,2,0,0,0,0|1,0,0]=3 2772 B8R0.3 CNCC(C)C(=O)NC MCULE-2413275831 [0,2,0,0,0,0|2,0,0]=4 2773 B8R0.3 CNCC(C)C(=O)OC MCULE-5525958870 [0,2,0,0,0,0|1,0,0]=3 2774 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [0,2,0,0,0,0|1,0,0]=3 2775 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [0,2,0,0,0,0|1,0,0]=3 2776 B8R0.3 CO/C=C(\I)/C(=O)OC MCULE-2050459356 [0,2,0,0,0,0|0,1,1]=4 2777 B8R0.3 CO/N=C(\Cl)/C(=O)OC MCULE-8885098005 [0,2,0,0,0,0|0,1,1]=4 2778 B8R0.3 COC(=O)C(=CCCl)C MCULE-4648119495 [0,2,0,0,0,0|1,0,1]=4 2779 B8R0.3 COC(=O)C(=CCO)C MCULE-7930614060 [0,2,0,0,0,0|1,0,1]=4 2780 B8R0.3 COC(=O)C(Br)CCBr MCULE-4290973865 [0,2,0,0,0,0|1,0,0]=3 2781 B8R0.3 COC(=O)C(C)CCBr MCULE-7970722391 [0,2,0,0,0,0|1,0,0]=3 2782 B8R0.3 COC(=O)C(C)CCCl MCULE-3423199485 [0,2,0,0,0,0|1,0,0]=3 2783 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [0,2,0,0,0,0|1,0,0]=3 2784 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [0,2,0,0,0,0|1,0,0]=3 2785 B8R0.3 COC(=O)C(C)N=C=O MCULE-2210895956 [0,2,0,0,0,0|1,0,1]=4 2786 B8R0.3 COC(=O)C(C)N=C=S MCULE-6150810434 [0,2,0,0,0,0|1,0,1]=4 2787 B8R0.3 COC(=O)C(C)N=N#N MCULE-7689671689 [0,2,0,0,0,0|2,0,0]=4 2788 B8R0.3 COC(=O)C(C)NC=O MCULE-7583002028 [0,2,0,0,0,0|1,0,1]=4 2789 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [0,2,0,0,0,0|1,0,0]=3 2790 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [0,2,0,0,0,0|1,0,0]=3 2791 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [0,2,0,0,0,0|1,0,0]=3 2792 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [0,2,0,0,0,0|1,0,0]=3 2793 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [0,2,0,0,0,0|1,0,0]=3 2794 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [0,2,0,0,0,0|0,0,0]=2 2795 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [0,2,0,0,0,0|0,0,0]=2 2796 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [0,2,0,0,0,0|1,0,0]=3 2797 B8R0.3 COC(=O)N(C)CCN MCULE-5241430588 [0,2,0,0,0,0|2,0,0]=4 2798 B8R0.3 COC(=O)N(C)CCN MCULE-6970201742 [0,2,0,0,0,0|2,0,0]=4 2799 B8R0.3 COC(=O)N(C)CCO MCULE-3282195016 [0,2,0,0,0,0|2,0,0]=4 2800 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [0,2,0,0,0,0|1,0,0]=3 2801 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [0,2,0,0,0,0|1,0,0]=3 2802 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [0,2,0,0,0,0|1,0,0]=3 2803 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [0,2,0,0,0,0|1,0,0]=3 2804 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [0,2,0,0,0,0|1,0,0]=3 2805 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [0,2,0,0,0,0|1,0,0]=3 2806 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [0,2,0,0,0,0|1,0,0]=3 2807 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [0,2,0,0,0,0|0,0,0]=2 2808 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [0,2,0,0,0,0|0,0,0]=2 2809 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [0,2,0,0,0,0|0,0,0]=2 2810 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [0,2,0,0,0,0|0,0,0]=2 2811 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [0,2,0,0,0,0|1,0,0]=3 2812 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [0,2,0,0,0,0|1,0,0]=3 2813 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [0,2,0,0,0,0|1,0,0]=3 2814 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [0,2,0,0,0,0|1,0,0]=3 2815 B8R0.3 COC(=O)[C@H](C)N=C=O MCULE-1937226226 [0,2,0,0,0,0|1,0,1]=4 2816 B8R0.3 COC(=O)[C@H](C)N=C=O MCULE-2565419113 [0,2,0,0,0,0|1,0,1]=4 2817 B8R0.3 COC(=O)[C@H](C)N=C=S MCULE-5279412916 [0,2,0,0,0,0|1,0,1]=4 2818 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-3891029916 [0,2,0,0,0,0|1,0,1]=4 2819 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-5938491065 [0,2,0,0,0,0|1,0,1]=4 2820 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [0,2,0,0,0,0|1,0,0]=3 2821 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [0,2,0,0,0,0|1,0,0]=3 2822 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [0,2,0,0,0,0|1,0,0]=3 2823 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [0,2,0,0,0,0|1,0,0]=3 2824 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [0,2,0,0,0,0|1,0,0]=3 2825 B8R0.3 COC(C)C(=O)CC#N MCULE-3613869171 [0,2,0,0,0,0|2,0,0]=4 2826 B8R0.3 COC=C(I)C(=O)OC MCULE-9702408627 [0,2,0,0,0,0|0,1,1]=4 2827 B8R0.3 COCC(=O)N(C)OC MCULE-6649507131 [0,2,0,0,0,0|0,1,0]=3 2828 B8R0.3 COCC(Br)C(=O)OC MCULE-5792855565 [0,2,0,0,0,0|0,1,0]=3 2829 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [0,2,0,0,0,0|0,1,0]=3 2830 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [0,2,0,0,0,0|0,1,0]=3 2831 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [0,2,0,0,0,0|0,1,0]=3 2832 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [0,2,0,0,0,0|0,1,0]=3 2833 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [0,2,0,0,0,0|0,1,0]=3 2834 B8R0.3 COCC(O)C(=O)OC MCULE-6071304250 [0,2,0,0,0,0|0,1,0]=3 2835 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [0,2,0,0,0,0|0,1,0]=3 2836 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [0,2,0,0,0,0|0,1,0]=3 2837 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [0,2,0,0,0,0|0,1,0]=3 2838 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [0,2,0,0,0,0|0,1,0]=3 2839 B8R0.3 CON(C)C(=O)CC#N MCULE-1400127101 [0,2,0,0,0,0|2,0,0]=4 2840 B8R0.3 CON(C)C(=O)CCBr MCULE-7636468204 [0,2,0,0,0,0|2,0,0]=4 2841 B8R0.3 CON(C)C(=O)CCCl MCULE-5460738044 [0,2,0,0,0,0|2,0,0]=4 2842 B8R0.3 CON=C(Cl)C(=O)OC MCULE-8277036765 [0,2,0,0,0,0|0,1,1]=4 2843 B8R0.3 CON=C(I)C(=O)OC MCULE-5875796121 [0,2,0,0,0,0|0,1,1]=4 2844 B8R0.3 CONC(=O)C(=O)OC MCULE-9234071987 [0,2,0,0,0,0|0,1,1]=4 2845 B8R0.3 [C@H](N)(CO)C(=O)OCC MCULE-8379845791 [0,2,0,0,0,0|2,0,0]=4 2846 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [0,2,0,0,0,0|1,0,0]=3 2847 B8R0.6 C#CCCNC(=O)OC MCULE-4643907894 [0,2,0,0,0,0|1,0,1]=4 2848 B8R0.6 C#CCOCC(=O)OC MCULE-8743984162 [0,2,0,0,0,0|0,1,0]=3 2849 B8R0.6 C/C=C/C=C/C(=O)OC MCULE-2985403088 [0,2,0,0,0,0|1,0,1]=4 2850 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [0,2,0,0,0,0|1,0,0]=3 2851 B8R0.6 C=CCOCC(=O)OC MCULE-7670885186 [0,2,0,0,0,0|0,1,0]=3 2852 B8R0.6 C=CCSCC(=O)OC MCULE-3363963029 [0,2,0,0,0,0|0,0,0]=2 2853 B8R0.6 CC=CC=CC(=O)OC MCULE-4040454111 [0,2,0,0,0,0|1,0,1]=4 2854 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [0,2,0,0,0,0|1,0,0]=3 2855 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [0,2,0,0,0,0|1,0,0]=3 2856 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [0,2,0,0,0,0|1,0,0]=3 2857 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [0,2,0,0,0,0|1,0,0]=3 2858 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,2,0,0,0,0|2,0,0]=4 2859 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [0,2,0,0,0,0|1,0,0]=3 2860 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [0,2,0,0,0,0|2,0,0]=4 2861 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [0,2,0,0,0,0|2,0,0]=4 2862 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [0,2,0,0,0,0|2,0,0]=4 2863 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [0,2,0,0,0,0|2,0,0]=4 2864 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [0,2,0,0,0,0|1,0,0]=3 2865 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [0,2,0,0,0,0|1,0,0]=3 2866 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [0,2,0,0,0,0|0,0,0]=2 2867 B8R0.6 CCNCCC(=O)NC MCULE-8230774906 [0,2,0,0,0,0|2,0,0]=4 2868 B8R0.6 CCNCCC(=O)NC MCULE-9131674592 [0,2,0,0,0,0|2,0,0]=4 2869 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [0,2,0,0,0,0|1,0,0]=3 2870 B8R0.6 CCOCCC(=N)OC MCULE-1143058685 [0,2,0,0,0,0|1,1,0]=4 2871 B8R0.6 CCOCCC(=N)OC MCULE-1528455249 [0,2,0,0,0,0|1,1,0]=4 2872 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [0,2,0,0,0,0|0,0,0]=2 2873 B8R0.6 CNC(=O)CCCON MCULE-8352787831 [0,2,0,0,0,0|2,0,0]=4 2874 B8R0.6 CNC(=O)NCCCO MCULE-3093590717 [0,2,0,0,0,0|2,0,0]=4 2875 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [0,2,0,0,0,0|1,0,0]=3 2876 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [0,2,0,0,0,0|1,0,0]=3 2877 B8R0.6 CNCCNC(=O)NC MCULE-2973659795 [0,2,0,0,0,0|2,0,0]=4 2878 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [0,2,0,0,0,0|1,0,0]=3 2879 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [0,2,0,0,0,0|1,0,0]=3 2880 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [0,2,0,0,0,0|1,0,0]=3 2881 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [0,2,0,0,0,0|1,0,0]=3 2882 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [0,2,0,0,0,0|1,0,0]=3 2883 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [0,2,0,0,0,0|1,0,0]=3 2884 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [0,2,0,0,0,0|1,0,0]=3 2885 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [0,2,0,0,0,0|1,0,0]=3 2886 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [0,2,0,0,0,0|1,0,0]=3 2887 B8R0.6 COC(=O)CCCON MCULE-1522874324 [0,2,0,0,0,0|1,0,0]=3 2888 B8R0.6 COC(=O)CCCON MCULE-4748610058 [0,2,0,0,0,0|1,0,0]=3 2889 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [0,2,0,0,0,0|0,0,0]=2 2890 B8R0.6 COC(=O)CCN=C=O MCULE-8282687885 [0,2,0,0,0,0|1,0,1]=4 2891 B8R0.6 COC(=O)CCN=C=S MCULE-4255379915 [0,2,0,0,0,0|1,0,1]=4 2892 B8R0.6 COC(=O)CCN=N#N MCULE-9952679830 [0,2,0,0,0,0|2,0,0]=4 2893 B8R0.6 COC(=O)CCNC=O MCULE-2214149264 [0,2,0,0,0,0|1,0,1]=4 2894 B8R0.6 COC(=O)CNCC#N MCULE-4088324466 [0,2,0,0,0,0|1,0,0]=3 2895 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [0,2,0,0,0,0|0,1,0]=3 2896 B8R0.6 COC(=O)COCCN MCULE-5090944064 [0,2,0,0,0,0|0,1,0]=3 2897 B8R0.6 COC(=O)COCCN MCULE-6748820855 [0,2,0,0,0,0|0,1,0]=3 2898 B8R0.6 COC(=O)COCCO MCULE-7869619911 [0,2,0,0,0,0|0,1,0]=3 2899 B8R0.6 COC(=O)CSCC#N MCULE-9919146652 [0,2,0,0,0,0|0,0,0]=2 2900 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [0,2,0,0,0,0|0,0,0]=2 2901 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [0,2,0,0,0,0|0,0,0]=2 2902 B8R0.6 COC(=O)NCCC#N MCULE-9903533731 [0,2,0,0,0,0|1,0,1]=4 2903 B8R0.6 COC(=O)SSCCN MCULE-2854223096 [0,2,0,0,0,0|1,0,0]=3 2904 B8R0.6 COC/C=C/C(=O)OC MCULE-5611593935 [0,2,0,0,0,0|0,1,0]=3 2905 B8R0.6 COCC=CC(=O)OC MCULE-1098723055 [0,2,0,0,0,0|0,1,0]=3 2906 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [0,2,0,0,0,0|0,1,0]=3 2907 B8R0.6 CONCCC(=O)OC MCULE-8622619087 [0,2,0,0,0,0|0,1,0]=3 2908 B8R0.8 C=C(C)C(=O)NCOC MCULE-1355341818 [0,2,0,0,0,0|1,1,0]=4 2909 B8R0.8 C=C(C)C(=O)OCCC MCULE-3202968176 [0,2,0,0,0,0|2,0,0]=4 2910 B8R0.8 CC(C)C(=O)CCCCl MCULE-7442882082 [0,2,0,0,0,0|2,0,0]=4 2911 B8R0.8 CCCCC(=O)C(=O)C MCULE-5957201570 [0,2,0,0,0,0|2,0,0]=4 2912 B8R0.8 CCCCC(=O)C(C)C MCULE-1905176805 [0,2,0,0,0,0|2,0,0]=4 2913 B8R0.8 CCCCC(=O)C(C)N MCULE-1316684028 [0,2,0,0,0,0|2,0,0]=4 2914 B8R0.8 CCCCC(=O)C(C)N MCULE-1846818051 [0,2,0,0,0,0|2,0,0]=4 2915 B8R0.8 CCCCC(=O)C(C)N MCULE-6223994385 [0,2,0,0,0,0|2,0,0]=4 2916 B8R0.8 CCCCC(=O)C(C)N MCULE-8594054065 [0,2,0,0,0,0|2,0,0]=4 2917 B8R0.8 CCCCC(=O)N(C)C MCULE-1521248911 [0,2,0,0,0,0|2,0,0]=4 2918 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-4202397833 [0,2,0,0,0,0|2,0,0]=4 2919 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8156418445 [0,2,0,0,0,0|2,0,0]=4 2920 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8186118680 [0,2,0,0,0,0|2,0,0]=4 2921 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-9214507863 [0,2,0,0,0,0|2,0,0]=4 2922 B8R0.8 CCCNC(=O)C(C)Br MCULE-7756965972 [0,2,0,0,0,0|2,0,0]=4 2923 B8R0.8 CCCNC(=O)C(C)Cl MCULE-7279909731 [0,2,0,0,0,0|2,0,0]=4 2924 B8R0.8 CCCNC(=O)C(C)N MCULE-2829232879 [0,2,0,0,0,0|2,0,0]=4 2925 B8R0.8 CCCNC(=O)C(C)N MCULE-5579383254 [0,2,0,0,0,0|2,0,0]=4 2926 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-4345277738 [0,2,0,0,0,0|2,0,0]=4 2927 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-8221598088 [0,2,0,0,0,0|2,0,0]=4 2928 B8R0.8 CCCOC(=O)C(C)C MCULE-8112640762 [0,2,0,0,0,0|2,0,0]=4 2929 B8R0.8 CCCOC(=O)C(C)Cl MCULE-6753282934 [0,2,0,0,0,0|2,0,0]=4 2930 B8R0.8 CCCOC(=O)C(C)N MCULE-6692040810 [0,2,0,0,0,0|2,0,0]=4 2931 B8R0.8 CCCOC(=O)C(C)N MCULE-9142364939 [0,2,0,0,0,0|2,0,0]=4 2932 B8R0.8 CCCOC(=O)C(C)O MCULE-8240669472 [0,2,0,0,0,0|2,0,0]=4 2933 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-2973724539 [0,2,0,0,0,0|2,0,0]=4 2934 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-7427167899 [0,2,0,0,0,0|2,0,0]=4 2935 B8R0.8 CCCOC(=O)[C@H](C)O MCULE-4150275631 [0,2,0,0,0,0|2,0,0]=4 2936 B8R0.8 CCNCC(=O)N(C)C MCULE-7864141414 [0,2,0,0,0,0|2,0,0]=4 2937 B8R0.8 CN(C)C(=O)CCCCl MCULE-1395271076 [0,2,0,0,0,0|2,0,0]=4 2938 B8R0.8 CN(C)C(=O)CCCN MCULE-3574617538 [0,2,0,0,0,0|2,0,0]=4 2939 B8R0.8 CN(C)C(=O)CCCN MCULE-6145958264 [0,2,0,0,0,0|2,0,0]=4 2940 B8R0.8 CN(C)C(=O)CCCO MCULE-2835364374 [0,2,0,0,0,0|2,0,0]=4 2941 B8R0.8 CNCCC(=O)N(C)C MCULE-6256018690 [0,2,0,0,0,0|2,0,0]=4 2942 B8R0.8 CNCCC(=O)N(C)C MCULE-9074335618 [0,2,0,0,0,0|2,0,0]=4 2943 B8R0.8 COCCC(=O)C(C)C MCULE-8480801762 [0,2,0,0,0,0|1,1,0]=4 2944 B8R0.8 COCCC(=O)N(C)C MCULE-3658554853 [0,2,0,0,0,0|1,1,0]=4 2945 B8R0.8 COCNC(=O)N(C)C MCULE-2879447245 [0,2,0,0,0,0|1,1,0]=4 2946 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [0,2,0,0,0,0|2,0,0]=4 2947 B8R0.8 CSCCC(=O)C(=O)[O-] MCULE-4931776455 [0,2,0,0,0,0|2,0,0]=4 2948 B8R0.9 C=C(C)CNC(=S)OC MCULE-1057647049 [0,2,0,0,0,0|1,1,0]=4 2949 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [0,2,0,0,0,0|2,0,0]=4 2950 B8R0.9 CCC(=O)CCC(C)C MCULE-3065298823 [0,2,0,0,0,0|2,0,0]=4 2951 B8R0.9 CCC(=O)COC(=O)C MCULE-4876335377 [0,2,0,0,0,0|1,1,0]=4 2952 B8R0.9 CCC(=O)NCC(C)C MCULE-3079187120 [0,2,0,0,0,0|2,0,0]=4 2953 B8R0.9 CCC(=O)OCC(C)Br MCULE-7344958033 [0,2,0,0,0,0|2,0,0]=4 2954 B8R0.9 CCC(=O)OCC(C)C MCULE-4196106578 [0,2,0,0,0,0|2,0,0]=4 2955 B8R0.9 CNC(=O)CNC(=O)C MCULE-3508245247 [0,2,0,0,0,0|2,0,0]=4 2956 B8R0.9 COC(=O)/C=C/C(=O)C MCULE-7597345789 [0,2,0,0,0,0|1,0,1]=4 2957 B8R0.9 COC(=O)/C=C/C(C)C MCULE-3160224452 [0,2,0,0,0,0|1,0,1]=4 2958 B8R0.9 COC(=O)/C=C/N(C)C MCULE-2402483726 [0,2,0,0,0,0|1,0,1]=4 2959 B8R0.9 COC(=O)/N=C/N(C)C MCULE-3421193223 [0,2,0,0,0,0|1,0,1]=4 2960 B8R0.9 COC(=O)C=CC(=O)C MCULE-5746687781 [0,2,0,0,0,0|1,0,1]=4 2961 B8R0.9 COC(=O)C=CC(C)C MCULE-8333658639 [0,2,0,0,0,0|1,0,1]=4 2962 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [0,2,0,0,0,0|1,0,0]=3 2963 B8R0.9 COC(=O)CCC(=O)Cl MCULE-2684320402 [0,2,0,0,0,0|1,0,1]=4 2964 B8R0.9 COC(=O)CCC(=O)N MCULE-1154081515 [0,2,0,0,0,0|1,0,1]=4 2965 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [0,2,0,0,0,0|1,0,1]=4 2966 B8R0.9 COC(=O)CCC(=S)N MCULE-4037707510 [0,2,0,0,0,0|1,0,1]=4 2967 B8R0.9 COC(=O)CCC(F)F MCULE-4602374642 [0,2,0,0,0,0|1,0,0]=3 2968 B8R0.9 COC(=O)CCN(=O)=O MCULE-3836108700 [0,2,0,0,0,0|2,0,0]=4 2969 B8R0.9 COC(=O)CCN(C)C MCULE-5967397518 [0,2,0,0,0,0|1,0,0]=3 2970 B8R0.9 COC(=O)CCS(=O)O MCULE-4935012562 [0,2,0,0,0,0|1,0,1]=4 2971 B8R0.9 COC(=O)CCS(=O)[O-] MCULE-5802411922 [0,2,0,0,0,0|1,0,1]=4 2972 B8R0.9 COC(=O)CNC(=O)C MCULE-3795072377 [0,2,0,0,0,0|1,0,0]=3 2973 B8R0.9 COC(=O)CNC(C)C MCULE-7232154394 [0,2,0,0,0,0|1,0,0]=3 2974 B8R0.9 COC(=O)COC(C)C MCULE-8327092817 [0,2,0,0,0,0|0,1,0]=3 2975 B8R0.9 COC(=O)COC(Cl)Cl MCULE-8466265912 [0,2,0,0,0,0|0,1,0]=3 2976 B8R0.9 COC(=O)CSC(=N)N MCULE-5721573915 [0,2,0,0,0,0|0,0,1]=3 2977 B8R0.9 COC(=O)CSC(=N)N MCULE-8534299006 [0,2,0,0,0,0|0,0,1]=3 2978 B8R0.9 COC(=O)CSC(C)C MCULE-9054714022 [0,2,0,0,0,0|0,0,0]=2 2979 B8R0.9 COC(=O)N=CN(C)C MCULE-5824976694 [0,2,0,0,0,0|1,0,1]=4 2980 B8R0.9 COC(=O)NCC(=O)C MCULE-1043877696 [0,2,0,0,0,0|1,0,0]=3 2981 B8R0.9 COC(=O)NCC(=O)O MCULE-3693365728 [0,2,0,0,0,0|2,0,0]=4 2982 B8R0.9 COC(=O)NCC(C)O MCULE-3862167665 [0,2,0,0,0,0|1,0,0]=3 2983 B8R0.9 COC(=O)OCC(F)F MCULE-9403543035 [0,2,0,0,0,0|2,0,0]=4 2984 B8R0.11 CCC/C=C(/C=O)\CC MCULE-6598454196 [0,2,0,0,0,0|2,0,0]=4 2985 B8R0.11 CCCC=C(C=O)CC MCULE-9099763598 [0,2,0,0,0,0|2,0,0]=4 2986 B8R0.11 COC(C#N)CCSC MCULE-9976329021 [0,2,0,0,0,0|1,0,1]=4 2987 B8R0.11 COC(CCSC)OC MCULE-3069805433 [0,2,0,0,0,0|0,0,2]=4 2988 B8R0.11 COC(CN)CCSC MCULE-1834354805 [0,2,0,0,0,0|1,0,1]=4 2989 B8R0.14 CCCC(=O)C(C)(C)C MCULE-9363300648 [0,2,0,0,0,0|2,0,0]=4 2990 B8R0.14 CNCC(=O)C(C)(C)C MCULE-5273719763 [0,2,0,0,0,0|2,0,0]=4 2991 B8R0.14 CNCC(=O)C(C)(C)C MCULE-9474779464 [0,2,0,0,0,0|2,0,0]=4 2992 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,2,0,0,0,0|1,0,1]=4 2993 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [0,2,0,0,0,0|0,1,1]=4 2994 B8R0.22 COC(CSC)CSC MCULE-9682906389 [0,2,0,0,0,0|0,1,1]=4 2995 B8R0.13 C#CC(C)(C)C(=O)OC MCULE-1769873961 [0,2,0,0,0,0|1,0,1]=4 2996 B8R0.13 C#CC(C)(O)C(=O)OC MCULE-6791914528 [0,2,0,0,0,0|1,0,1]=4 2997 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [0,2,0,0,0,0|2,0,0]=4 2998 B8R0.13 CCC(C)(C)C(=O)OC MCULE-4686994014 [0,2,0,0,0,0|1,0,0]=3 2999 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3094414845 [0,2,0,0,0,0|1,0,0]=3 3000 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3671452978 [0,2,0,0,0,0|1,0,0]=3 3001 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7294646980 [0,2,0,0,0,0|1,0,0]=3 3002 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7579678256 [0,2,0,0,0,0|1,0,0]=3 3003 B8R0.13 CCC(C)(N)C(=O)OC MCULE-8600950514 [0,2,0,0,0,0|1,0,0]=3 3004 B8R0.13 CCC(C)(O)C(=O)OC MCULE-8142046975 [0,2,0,0,0,0|1,0,0]=3 3005 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-2166068124 [0,2,0,0,0,0|1,0,0]=3 3006 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5528793909 [0,2,0,0,0,0|1,0,0]=3 3007 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5577268972 [0,2,0,0,0,0|1,0,0]=3 3008 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-9937729069 [0,2,0,0,0,0|1,0,0]=3 3009 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1110630847 [0,2,0,0,0,0|1,0,0]=3 3010 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1873229791 [0,2,0,0,0,0|1,0,0]=3 3011 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-2400409033 [0,2,0,0,0,0|1,0,0]=3 3012 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-7488892262 [0,2,0,0,0,0|1,0,0]=3 3013 B8R0.13 CNC(=O)C(C)(C)NC MCULE-4678065112 [0,2,0,0,0,0|2,0,0]=4 3014 B8R0.13 CNC(=O)C(C)(C)NC MCULE-5005697101 [0,2,0,0,0,0|2,0,0]=4 3015 B8R0.13 CNC(C)(C)C(=O)OC MCULE-3633926086 [0,2,0,0,0,0|1,0,0]=3 3016 B8R0.13 CNC(C)(C)C(=O)OC MCULE-5043607769 [0,2,0,0,0,0|1,0,0]=3 3017 B8R0.13 COC(=O)C(C)(Br)CBr MCULE-7338587134 [0,2,0,0,0,0|2,0,0]=4 3018 B8R0.13 COC(=O)C(C)(C)C#N MCULE-6514633076 [0,2,0,0,0,0|2,0,0]=4 3019 B8R0.13 COC(=O)C(C)(C)C=O MCULE-7831259608 [0,2,0,0,0,0|2,0,0]=4 3020 B8R0.13 COC(=O)C(C)(C)CBr MCULE-8493306369 [0,2,0,0,0,0|2,0,0]=4 3021 B8R0.13 COC(=O)C(C)(C)CN MCULE-3876518389 [0,2,0,0,0,0|2,0,0]=4 3022 B8R0.13 COC(=O)C(C)(C)CN MCULE-6058798123 [0,2,0,0,0,0|2,0,0]=4 3023 B8R0.13 COC(=O)C(C)(C)CO MCULE-5007341074 [0,2,0,0,0,0|2,0,0]=4 3024 B8R0.13 COC(=O)C(C)(C)CS MCULE-1609978379 [0,2,0,0,0,0|2,0,0]=4 3025 B8R0.13 COC(=O)C(C)(C)ON MCULE-4323661548 [0,2,0,0,0,0|1,1,0]=4 3026 B8R0.13 COC(=O)C(C)(C)ON MCULE-9675322237 [0,2,0,0,0,0|1,1,0]=4 3027 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [0,2,0,0,0,0|2,0,0]=4 3028 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [0,2,0,0,0,0|2,0,0]=4 3029 B8R0.13 COC(=O)C(C)(O)CCl MCULE-5923752147 [0,2,0,0,0,0|2,0,0]=4 3030 B8R0.13 COC(=O)C(C)(O)CN MCULE-4142904446 [0,2,0,0,0,0|2,0,0]=4 3031 B8R0.13 COC(=O)C(C)(O)CN MCULE-7145315033 [0,2,0,0,0,0|2,0,0]=4 3032 B8R0.13 COC(=O)C(Cl)(Cl)C#N MCULE-4682972969 [0,2,0,0,0,0|2,0,0]=4 3033 B8R0.13 COC(=O)C(Cl)(Cl)OC MCULE-5718474171 [0,2,0,0,0,0|0,1,0]=3 3034 B8R0.13 COC(=O)C(F)(F)CBr MCULE-4822172189 [0,2,0,0,0,0|2,0,0]=4 3035 B8R0.13 COC(=O)C(F)(F)CN MCULE-6242672860 [0,2,0,0,0,0|2,0,0]=4 3036 B8R0.13 COC(=O)C(F)(F)CN MCULE-6342895274 [0,2,0,0,0,0|2,0,0]=4 3037 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [0,2,0,0,0,0|2,0,0]=4 3038 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [0,2,0,0,0,0|2,0,0]=4 3039 B8R0.20 CCC(C)C(C=O)OC MCULE-5091212843 [0,2,0,0,0,0|1,0,1]=4 3040 B8R0.20 CCC(CC)C(=O)NC MCULE-1491407837 [0,2,0,0,0,0|2,0,0]=4 3041 B8R0.20 CCC(CC)C(=O)OC MCULE-4475439540 [0,2,0,0,0,0|1,0,0]=3 3042 B8R0.20 CCC(CN)C(=O)OC MCULE-1321974588 [0,2,0,0,0,0|1,0,0]=3 3043 B8R0.20 CCC(CN)C(=O)OC MCULE-3486156834 [0,2,0,0,0,0|1,0,0]=3 3044 B8R0.20 CCC(CO)C(=O)OC MCULE-3580039708 [0,2,0,0,0,0|1,0,0]=3 3045 B8R0.20 CCC(NC)C(=O)OC MCULE-2432468432 [0,2,0,0,0,0|1,0,0]=3 3046 B8R0.20 CCC(NC)C(=O)OC MCULE-3478855741 [0,2,0,0,0,0|1,0,0]=3 3047 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-3786730078 [0,2,0,0,0,0|1,0,0]=3 3048 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-5452442009 [0,2,0,0,0,0|1,0,0]=3 3049 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-6957965861 [0,2,0,0,0,0|1,0,0]=3 3050 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-7876560081 [0,2,0,0,0,0|1,0,0]=3 3051 B8R0.20 CNC(CN)C(=O)OC MCULE-3787828683 [0,2,0,0,0,0|1,0,0]=3 3052 B8R0.20 CNC(CO)C(=O)OC MCULE-1017957273 [0,2,0,0,0,0|1,0,0]=3 3053 B8R0.20 CNC(CO)C(=O)OC MCULE-2751377307 [0,2,0,0,0,0|1,0,0]=3 3054 B8R0.20 COC(=O)C(C=O)C=O MCULE-1727120989 [0,2,0,0,0,0|2,0,0]=4 3055 B8R0.20 COC(=O)C(CBr)CBr MCULE-2058360654 [0,2,0,0,0,0|2,0,0]=4 3056 B8R0.20 COC(=O)C(CBr)OC MCULE-1221978209 [0,2,0,0,0,0|0,1,0]=3 3057 B8R0.20 COC(=O)C(CN)CN MCULE-2482587382 [0,2,0,0,0,0|2,0,0]=4 3058 B8R0.20 COC(=O)C(CN)CN MCULE-7758396429 [0,2,0,0,0,0|2,0,0]=4 3059 B8R0.20 COC(=O)C(CN)OC MCULE-2907367615 [0,2,0,0,0,0|0,1,0]=3 3060 B8R0.20 COC(=O)C(OC)OC MCULE-7706382604 [0,2,0,0,0,0|0,1,0]=3 3061 B8R0.20 COC(=O)[C@H](CN)OC MCULE-7711946747 [0,2,0,0,0,0|0,1,0]=3 3062 B8R0.20 COC(=O)[C@H](CN)OC MCULE-8104475257 [0,2,0,0,0,0|0,1,0]=3 3063 B6R1.2 BrC1CCSC1 MCULE-6663716947 [1,0,0,1,0,0|1,0,1]=4 3064 B6R1.2 C=C1CCCC1 MCULE-4115373196 [1,0,0,1,0,0|2,0,0]=4 3065 B6R1.2 C=C1CCNC1 MCULE-7982953073 [1,0,0,1,0,0|2,0,0]=4 3066 B6R1.2 C=C1CCNC1 MCULE-8428731599 [1,0,0,1,0,0|2,0,0]=4 3067 B6R1.2 C=C1CCSC1 MCULE-7042571473 [1,0,0,1,0,0|1,0,0]=3 3068 B6R1.2 CC1=CCCC1 MCULE-8508688474 [1,0,0,1,0,0|2,0,0]=4 3069 B6R1.2 CC1=CCNC1 MCULE-5892113847 [1,0,0,1,0,0|2,0,0]=4 3070 B6R1.2 CC1=CCNC1 MCULE-9225220351 [1,0,0,1,0,0|2,0,0]=4 3071 B6R1.2 CC1=NCCC1 MCULE-5009170423 [1,0,0,1,0,0|2,0,0]=4 3072 B6R1.2 CC1CCSC1 MCULE-7445511318 [1,0,0,1,0,0|1,0,1]=4 3073 B6R1.2 NC1CCSC1 MCULE-8972229387 [1,0,0,1,0,0|1,0,1]=4 3074 B6R1.2 NC1CCSC1 MCULE-9186640582 [1,0,0,1,0,0|1,0,1]=4 3075 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [1,0,0,1,0,0|1,0,1]=4 3076 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [1,0,0,1,0,0|1,0,1]=4 3077 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [1,0,0,1,0,0|0,0,2]=4 3078 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [1,0,0,1,0,0|1,0,1]=4 3079 B6R1.2 O=C1CCCC1 MCULE-9455227735 [1,0,0,1,0,0|1,0,0]=3 3080 B6R1.2 O=C1CCCN1 MCULE-3061780794 [1,0,0,1,0,0|2,0,0]=4 3081 B6R1.2 O=C1CCCO1 MCULE-6795890265 [1,0,0,1,0,0|1,0,0]=3 3082 B6R1.2 O=C1CCCS1 MCULE-5361654550 [1,0,0,1,0,0|1,1,0]=4 3083 B6R1.2 O=C1CCNC1 MCULE-2947789259 [1,0,0,1,0,0|1,0,0]=3 3084 B6R1.2 O=C1CCNC1 MCULE-7192595052 [1,0,0,1,0,0|1,0,0]=3 3085 B6R1.2 O=C1CCNN1 MCULE-7030953666 [1,0,0,1,0,0|2,0,0]=4 3086 B6R1.2 O=C1CCOC1 MCULE-2031733910 [1,0,0,1,0,0|0,1,0]=3 3087 B6R1.2 O=C1CCON1 MCULE-6799359324 [1,0,0,1,0,0|1,1,0]=4 3088 B6R1.2 O=C1CCSC1 MCULE-2059655624 [1,0,0,1,0,0|0,0,0]=2 3089 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [1,0,0,1,0,0|2,0,0]=4 3090 B6R1.2 O=C1CNCN1 MCULE-2645891847 [1,0,0,1,0,0|2,0,0]=4 3091 B6R1.2 O=C1CNCN1 MCULE-9269137129 [1,0,0,1,0,0|2,0,0]=4 3092 B6R1.2 O=C1CSCN1 MCULE-3946660854 [1,0,0,1,0,0|1,0,0]=3 3093 B6R1.2 O=C1NCCO1 MCULE-3934923008 [1,0,0,1,0,0|2,0,0]=4 3094 B6R1.2 O=C1OCCO1 MCULE-9493253045 [1,0,0,1,0,0|2,0,0]=4 3095 B6R1.2 O=S1CCCC1 MCULE-2442126780 [1,0,0,1,0,0|2,0,0]=4 3096 B6R1.2 OC1CCSC1 MCULE-9796808599 [1,0,0,1,0,0|0,0,2]=4 3097 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [1,0,0,1,0,0|0,0,2]=4 3098 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [1,0,0,1,0,0|0,0,2]=4 3099 B6R1.2 SC1CCSC1 MCULE-5955380477 [1,0,0,1,0,0|0,1,1]=4 3100 B6R1.3 CSCC1CO1 MCULE-9014850650 [1,0,0,1,0,0|0,0,2]=4 3101 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [1,0,0,1,0,0|1,0,1]=4 3102 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [1,0,0,1,0,0|1,0,0]=3 3103 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [1,0,0,1,0,0|2,0,0]=4 3104 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [1,0,0,1,0,0|1,0,0]=3 3105 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [1,0,0,1,0,0|1,0,0]=3 3106 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [1,0,0,1,0,0|1,0,0]=3 3107 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [1,0,0,1,0,0|1,0,0]=3 3108 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [1,0,0,1,0,0|2,0,0]=4 3109 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [1,0,0,1,0,0|2,0,0]=4 3110 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [1,0,0,1,0,0|2,0,0]=4 3111 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [1,0,0,1,0,0|2,0,0]=4 3112 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [1,0,0,1,0,0|2,0,0]=4 3113 B6R1.10 CC1(CSC1)N MCULE-7421240458 [1,0,0,1,0,0|1,0,1]=4 3114 B6R1.10 CC1(CSC1)N MCULE-9910201476 [1,0,0,1,0,0|1,0,1]=4 3115 B6R1.10 CC1(CSC1)O MCULE-9703448589 [1,0,0,1,0,0|0,0,2]=4 3116 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [1,0,0,1,0,0|1,1,0]=4 3117 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [1,0,0,1,0,0|1,0,0]=3 3118 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [1,0,0,1,0,0|0,1,0]=3 3119 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [1,0,0,1,0,0|2,0,0]=4 3120 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [1,0,0,1,0,0|1,1,0]=4 3121 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [1,0,0,1,0,0|2,0,0]=4 3122 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [1,0,0,1,0,0|1,0,0]=3 3123 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [1,0,0,1,0,0|1,0,0]=3 3124 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [1,0,0,1,0,0|0,1,0]=3 3125 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [1,0,0,1,0,0|1,0,0]=3 3126 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [1,0,0,1,0,0|1,0,0]=3 3127 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [1,0,0,1,0,0|0,1,0]=3 3128 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [1,0,0,1,0,0|0,1,0]=3 3129 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [1,0,0,1,0,0|1,0,1]=4 3130 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [1,0,0,1,0,0|0,1,1]=4 3131 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [1,0,0,1,0,0|0,1,1]=4 3132 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [1,0,0,1,0,0|0,1,1]=4 3133 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [1,0,0,1,0,0|0,1,1]=4 3134 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [1,0,0,1,0,0|0,1,1]=4 3135 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [1,0,0,1,0,0|0,1,1]=4 3136 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [1,0,0,1,0,0|0,1,1]=4 3137 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [1,0,0,1,0,0|2,0,0]=4 3138 B6R1.1 C1=CCCCC1 MCULE-3564016252 [1,0,0,1,0,0|2,0,0]=4 3139 B6R1.1 C1=CCNCC1 MCULE-4850984502 [1,0,0,1,0,0|2,0,0]=4 3140 B6R1.1 C1=CCNCC1 MCULE-9744767398 [1,0,0,1,0,0|2,0,0]=4 3141 B6R1.1 C1=CCOCC1 MCULE-7723901693 [1,0,0,1,0,0|1,1,0]=4 3142 B6R1.1 C1=COCCC1 MCULE-1260841717 [1,0,0,1,0,0|1,0,1]=4 3143 B6R1.1 C1=COCCO1 MCULE-2562788031 [1,0,0,1,0,0|0,1,1]=4 3144 B6R1.1 C1=NCCCC1 MCULE-7101012273 [1,0,0,1,0,0|2,0,0]=4 3145 B6R1.1 C1CCOCC1 MCULE-6904583049 [1,0,0,1,0,0|1,0,1]=4 3146 B6R1.1 C1CCONC1 MCULE-4106728300 [1,0,0,1,0,0|2,0,0]=4 3147 B6R1.1 C1CCONC1 MCULE-7653057344 [1,0,0,1,0,0|2,0,0]=4 3148 B6R1.1 C1CCSCC1 MCULE-5775966946 [1,0,0,1,0,0|1,0,1]=4 3149 B6R1.1 C1CNCSC1 MCULE-2728084068 [1,0,0,1,0,0|2,0,0]=4 3150 B6R1.1 C1CNCSC1 MCULE-3301332730 [1,0,0,1,0,0|2,0,0]=4 3151 B6R1.1 C1COCCN1 MCULE-2533030492 [1,0,0,1,0,0|1,0,1]=4 3152 B6R1.1 C1COCCN1 MCULE-4684386765 [1,0,0,1,0,0|1,0,1]=4 3153 B6R1.1 C1COCCN1 MCULE-8040983584 [1,0,0,1,0,0|1,0,1]=4 3154 B6R1.1 C1COCCO1 MCULE-5088019198 [1,0,0,1,0,0|0,1,1]=4 3155 B6R1.1 C1COCC[NH2+]1 MCULE-5238323153 [1,0,0,1,0,0|1,0,1]=4 3156 B6R1.1 C1CSCCN1 MCULE-6420970424 [1,0,0,1,0,0|1,0,1]=4 3157 B6R1.1 C1CSCCN1 MCULE-8670233998 [1,0,0,1,0,0|1,0,1]=4 3158 B6R1.1 C1CSCCO1 MCULE-5803800470 [1,0,0,1,0,0|0,0,1]=3 3159 B6R1.1 C1CSCCS1 MCULE-6198913745 [1,0,0,1,0,0|0,1,1]=4 3160 B6R1.1 C1CSCSC1 MCULE-5626011651 [1,0,0,1,0,0|2,0,0]=4 3161 B6R1.6 CNC1COC1 MCULE-2040978636 [1,0,0,1,0,0|1,0,1]=4 3162 B6R1.6 CNC1COC1 MCULE-3130259264 [1,0,0,1,0,0|1,0,1]=4 3163 B6R1.6 CNC1COC1 MCULE-4618612030 [1,0,0,1,0,0|1,0,1]=4 3164 B6R1.6 CNC1CSC1 MCULE-6729829548 [1,0,0,1,0,0|1,0,1]=4 3165 B6R1.6 CNC1CSC1 MCULE-7173779891 [1,0,0,1,0,0|1,0,1]=4 3166 B6R1.6 COC1CNC1 MCULE-1522685592 [1,0,0,1,0,0|1,0,1]=4 3167 B6R1.6 COC1CNC1 MCULE-4835486151 [1,0,0,1,0,0|1,0,1]=4 3168 B6R1.6 CSC1CNC1 MCULE-2006549414 [1,0,0,1,0,0|1,0,1]=4 3169 B6R1.6 CSC1CNC1 MCULE-6024405532 [1,0,0,1,0,0|1,0,1]=4 3170 B6R1.7 CCC1(CO1)C MCULE-5308881519 [1,0,0,1,0,0|1,0,1]=4 3171 B8R1.1 C#CC1COC(=O)N1 MCULE-7019791209 [0,1,0,1,0,0|1,0,1]=4 3172 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-3103635703 [0,1,0,1,0,0|1,0,1]=4 3173 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-7796064143 [0,1,0,1,0,0|1,0,1]=4 3174 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-4375742729 [0,1,0,1,0,0|1,0,1]=4 3175 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-5542662617 [0,1,0,1,0,0|1,0,1]=4 3176 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [0,1,0,1,0,0|2,0,0]=4 3177 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [0,1,0,1,0,0|2,0,0]=4 3178 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [0,1,0,1,0,0|1,0,1]=4 3179 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [0,1,0,1,0,0|1,0,1]=4 3180 B8R1.1 C=CC1COC(=O)O1 MCULE-3470962220 [0,1,0,1,0,0|1,0,1]=4 3181 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [0,1,0,1,0,0|1,0,1]=4 3182 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [0,1,0,1,0,0|1,0,1]=4 3183 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-1532767336 [0,1,0,1,0,0|1,0,1]=4 3184 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-3932839401 [0,1,0,1,0,0|1,0,1]=4 3185 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-3492854139 [0,1,0,1,0,0|1,0,1]=4 3186 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-9796474747 [0,1,0,1,0,0|1,0,1]=4 3187 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [0,1,0,1,0,0|2,0,0]=4 3188 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [0,1,0,1,0,0|2,0,0]=4 3189 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [0,1,0,1,0,0|2,0,0]=4 3190 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [0,1,0,1,0,0|2,0,0]=4 3191 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [0,1,0,1,0,0|2,0,0]=4 3192 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [0,1,0,1,0,0|2,0,0]=4 3193 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [0,1,0,1,0,0|1,0,0]=3 3194 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [0,1,0,1,0,0|1,0,0]=3 3195 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [0,1,0,1,0,0|1,0,0]=3 3196 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [0,1,0,1,0,0|2,0,0]=4 3197 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [0,1,0,1,0,0|2,0,0]=4 3198 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [0,1,0,1,0,0|2,0,0]=4 3199 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [0,1,0,1,0,0|2,0,0]=4 3200 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [0,1,0,1,0,0|1,0,0]=3 3201 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [0,1,0,1,0,0|1,0,0]=3 3202 B8R1.1 CNC1CNC(=O)C1 MCULE-1673491824 [0,1,0,1,0,0|2,0,0]=4 3203 B8R1.1 CN[C@H]1CNC(=O)C1 MCULE-7859463391 [0,1,0,1,0,0|2,0,0]=4 3204 B8R1.1 COC1=CC(=O)OC1 MCULE-9199919492 [0,1,0,1,0,0|0,1,1]=4 3205 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [0,1,0,1,0,0|1,1,0]=4 3206 B8R1.1 COC1CCC(=O)N1 MCULE-9661875090 [0,1,0,1,0,0|1,1,0]=4 3207 B8R1.1 COC1CNC(=O)C1 MCULE-2023546447 [0,1,0,1,0,0|1,1,0]=4 3208 B8R1.1 N#CC1COC(=O)O1 MCULE-7635108167 [0,1,0,1,0,0|2,0,0]=4 3209 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [0,1,0,1,0,0|2,0,0]=4 3210 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [0,1,0,1,0,0|2,0,0]=4 3211 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [0,1,0,1,0,0|2,0,0]=4 3212 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [0,1,0,1,0,0|2,0,0]=4 3213 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [0,1,0,1,0,0|2,0,0]=4 3214 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [0,1,0,1,0,0|2,0,0]=4 3215 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [0,1,0,1,0,0|2,0,0]=4 3216 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [0,1,0,1,0,0|2,0,0]=4 3217 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [0,1,0,1,0,0|2,0,0]=4 3218 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [0,1,0,1,0,0|2,0,0]=4 3219 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [0,1,0,1,0,0|2,0,0]=4 3220 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [0,1,0,1,0,0|2,0,0]=4 3221 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [0,1,0,1,0,0|2,0,0]=4 3222 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [0,1,0,1,0,0|2,0,0]=4 3223 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [0,1,0,1,0,0|2,0,0]=4 3224 B8R1.1 O=C1C=C(CO1)CBr MCULE-1493137482 [0,1,0,1,0,0|1,0,1]=4 3225 B8R1.1 O=C1C=C(CO1)CI MCULE-7834471824 [0,1,0,1,0,0|1,0,1]=4 3226 B8R1.1 O=C1C=C(CO1)CO MCULE-9263407854 [0,1,0,1,0,0|1,0,1]=4 3227 B8R1.1 O=C1CC(CN1)CBr MCULE-1780879209 [0,1,0,1,0,0|2,0,0]=4 3228 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [0,1,0,1,0,0|2,0,0]=4 3229 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [0,1,0,1,0,0|1,0,0]=3 3230 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [0,1,0,1,0,0|2,0,0]=4 3231 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [0,1,0,1,0,0|2,0,0]=4 3232 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [0,1,0,1,0,0|2,0,0]=4 3233 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [0,1,0,1,0,0|2,0,0]=4 3234 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [0,1,0,1,0,0|2,0,0]=4 3235 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [0,1,0,1,0,0|2,0,0]=4 3236 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [0,1,0,1,0,0|2,0,0]=4 3237 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [0,1,0,1,0,0|2,0,0]=4 3238 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [0,1,0,1,0,0|2,0,0]=4 3239 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [0,1,0,1,0,0|2,0,0]=4 3240 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [0,1,0,1,0,0|2,0,0]=4 3241 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [0,1,0,1,0,0|2,0,0]=4 3242 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [0,1,0,1,0,0|2,0,0]=4 3243 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [0,1,0,1,0,0|2,0,0]=4 3244 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [0,1,0,1,0,0|2,0,0]=4 3245 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [0,1,0,1,0,0|2,0,0]=4 3246 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [0,1,0,1,0,0|2,0,0]=4 3247 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [0,1,0,1,0,0|2,0,0]=4 3248 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [0,1,0,1,0,0|2,0,0]=4 3249 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [0,1,0,1,0,0|1,0,1]=4 3250 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [0,1,0,1,0,0|1,0,1]=4 3251 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [0,1,0,1,0,0|2,0,0]=4 3252 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [0,1,0,1,0,0|2,0,0]=4 3253 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [0,1,0,1,0,0|2,0,0]=4 3254 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [0,1,0,1,0,0|2,0,0]=4 3255 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [0,1,0,1,0,0|1,0,1]=4 3256 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [0,1,0,1,0,0|2,0,0]=4 3257 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [0,1,0,1,0,0|1,0,1]=4 3258 B8R1.4 CC1=CCCC(=O)C1 MCULE-8078773996 [0,1,0,1,0,0|2,0,0]=4 3259 B8R1.4 CC1=CCCC(=O)O1 MCULE-1590433845 [0,1,0,1,0,0|1,0,1]=4 3260 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [0,1,0,1,0,0|2,0,0]=4 3261 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [0,1,0,1,0,0|2,0,0]=4 3262 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [0,1,0,1,0,0|2,0,0]=4 3263 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [0,1,0,1,0,0|2,0,0]=4 3264 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [0,1,0,1,0,0|2,0,0]=4 3265 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [0,1,0,1,0,0|1,0,1]=4 3266 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [0,1,0,1,0,0|2,0,0]=4 3267 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [0,1,0,1,0,0|2,0,0]=4 3268 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [0,1,0,1,0,0|2,0,0]=4 3269 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [0,1,0,1,0,0|1,0,0]=3 3270 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [0,1,0,1,0,0|2,0,0]=4 3271 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [0,1,0,1,0,0|1,0,0]=3 3272 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [0,1,0,1,0,0|2,0,0]=4 3273 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [0,1,0,1,0,0|2,0,0]=4 3274 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [0,1,0,1,0,0|2,0,0]=4 3275 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [0,1,0,1,0,0|1,1,0]=4 3276 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [0,1,0,1,0,0|1,1,0]=4 3277 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [0,1,0,1,0,0|2,0,0]=4 3278 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [0,1,0,1,0,0|2,0,0]=4 3279 B8R1.4 CN1CCNC(=O)C1 MCULE-5564854834 [0,1,0,1,0,0|2,0,0]=4 3280 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [0,1,0,1,0,0|1,0,0]=3 3281 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [0,1,0,1,0,0|1,0,0]=3 3282 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [0,1,0,1,0,0|2,0,0]=4 3283 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [0,1,0,1,0,0|2,0,0]=4 3284 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [0,1,0,1,0,0|2,0,0]=4 3285 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [0,1,0,1,0,0|2,0,0]=4 3286 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [0,1,0,1,0,0|2,0,0]=4 3287 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [0,1,0,1,0,0|2,0,0]=4 3288 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [0,1,0,1,0,0|2,0,0]=4 3289 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [0,1,0,1,0,0|2,0,0]=4 3290 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [0,1,0,1,0,0|2,0,0]=4 3291 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [0,1,0,1,0,0|2,0,0]=4 3292 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [0,1,0,1,0,0|1,0,0]=3 3293 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [0,1,0,1,0,0|1,0,0]=3 3294 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [0,1,0,1,0,0|2,0,0]=4 3295 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [0,1,0,1,0,0|2,0,0]=4 3296 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [0,1,0,1,0,0|2,0,0]=4 3297 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [0,1,0,1,0,0|2,0,0]=4 3298 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [0,1,0,1,0,0|1,1,0]=4 3299 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [0,1,0,1,0,0|1,1,0]=4 3300 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [0,1,0,1,0,0|2,0,0]=4 3301 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [0,1,0,1,0,0|2,0,0]=4 3302 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [0,1,0,1,0,0|2,0,0]=4 3303 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [0,1,0,1,0,0|2,0,0]=4 3304 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [0,1,0,1,0,0|2,0,0]=4 3305 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [0,1,0,1,0,0|2,0,0]=4 3306 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [0,1,0,1,0,0|2,0,0]=4 3307 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [0,1,0,1,0,0|2,0,0]=4 3308 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [0,1,0,1,0,0|2,0,0]=4 3309 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [0,1,0,1,0,0|2,0,0]=4 3310 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [0,1,0,1,0,0|2,0,0]=4 3311 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [0,1,0,1,0,0|2,0,0]=4 3312 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [0,1,0,1,0,0|2,0,0]=4 3313 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [0,1,0,1,0,0|2,0,0]=4 3314 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [0,1,0,1,0,0|1,1,0]=4 3315 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [0,1,0,1,0,0|1,1,0]=4 3316 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [0,1,0,1,0,0|2,0,0]=4 3317 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [0,1,0,1,0,0|2,0,0]=4 3318 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [0,1,0,1,0,0|2,0,0]=4 3319 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [0,1,0,1,0,0|2,0,0]=4 3320 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [0,1,0,1,0,0|2,0,0]=4 3321 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [0,1,0,1,0,0|2,0,0]=4 3322 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,1,0,1,0,0|1,1,0]=4 3323 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,1,0,1,0,0|1,1,0]=4 3324 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [0,1,0,1,0,0|2,0,0]=4 3325 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [0,1,0,1,0,0|2,0,0]=4 3326 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,1,0,1,0,0|1,1,0]=4 3327 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,1,0,1,0,0|1,1,0]=4 3328 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [0,1,0,1,0,0|2,0,0]=4 3329 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [0,1,0,1,0,0|2,0,0]=4 3330 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [0,1,0,1,0,0|2,0,0]=4 3331 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [0,1,0,1,0,0|2,0,0]=4 3332 B8R1.4 O=C1CC(CCN1)F MCULE-3828280868 [0,1,0,1,0,0|2,0,0]=4 3333 B8R1.4 O=C1CC(CCN1)F MCULE-8150833328 [0,1,0,1,0,0|2,0,0]=4 3334 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [0,1,0,1,0,0|2,0,0]=4 3335 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [0,1,0,1,0,0|2,0,0]=4 3336 B8R1.4 O=C1CCCC(=O)C1 MCULE-7494421285 [0,1,0,1,0,0|2,0,0]=4 3337 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [0,1,0,1,0,0|1,0,1]=4 3338 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [0,1,0,1,0,0|2,0,0]=4 3339 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [0,1,0,1,0,0|2,0,0]=4 3340 B8R1.4 O=C1CCNC(=O)C1 MCULE-7662080105 [0,1,0,1,0,0|2,0,0]=4 3341 B8R1.4 O=C1CCOC(=O)C1 MCULE-3134133687 [0,1,0,1,0,0|1,0,0]=3 3342 B8R1.4 O=C1COCC(=O)C1 MCULE-1763175933 [0,1,0,1,0,0|2,0,0]=4 3343 B8R1.4 O=C1COCC(=O)O1 MCULE-7640970930 [0,1,0,1,0,0|0,1,1]=4 3344 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,1,0,1,0,0|1,1,0]=4 3345 B8R1.4 O=C1CSCC(=O)C1 MCULE-7749510849 [0,1,0,1,0,0|1,0,1]=4 3346 B8R1.4 O=C1CSCC(=O)N1 MCULE-5124635458 [0,1,0,1,0,0|1,0,1]=4 3347 B8R1.4 O=C1CSCC(=O)O1 MCULE-6767203470 [0,1,0,1,0,0|0,0,1]=3 3348 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [0,1,0,1,0,0|2,0,0]=4 3349 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [0,1,0,1,0,0|2,0,0]=4 3350 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [0,1,0,1,0,0|2,0,0]=4 3351 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [0,1,0,1,0,0|2,0,0]=4 3352 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [0,1,0,1,0,0|2,0,0]=4 3353 B8R1.18 CC1=C(OC(=O)N1)C MCULE-9563427028 [0,1,0,1,0,0|2,0,0]=4 3354 B8R1.18 CC1=C(OC(=O)O1)C MCULE-2205012091 [0,1,0,1,0,0|2,0,0]=4 3355 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [0,1,0,1,0,0|2,0,0]=4 3356 B8R1.18 CC1=CC(=O)OC1O MCULE-2111708862 [0,1,0,1,0,0|1,0,1]=4 3357 B8R1.18 CC1=CC(=O)O[C@@H]1O MCULE-3894053073 [0,1,0,1,0,0|1,0,1]=4 3358 B8R1.18 CC1=NN(C(=O)C1)C MCULE-3316902396 [0,1,0,1,0,0|2,0,0]=4 3359 B8R1.18 CC1CC(=O)C(O1)C MCULE-9648127298 [0,1,0,1,0,0|2,0,0]=4 3360 B8R1.18 CC1CC(=O)CN1C MCULE-3142275674 [0,1,0,1,0,0|2,0,0]=4 3361 B8R1.18 CC1CC(=O)N(C1)C MCULE-2164356802 [0,1,0,1,0,0|2,0,0]=4 3362 B8R1.18 CC1CC(=O)N(N1)C MCULE-3951114099 [0,1,0,1,0,0|2,0,0]=4 3363 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [0,1,0,1,0,0|1,0,1]=4 3364 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [0,1,0,1,0,0|1,0,0]=3 3365 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [0,1,0,1,0,0|1,0,0]=3 3366 B8R1.18 CC1CN(CC1=O)C MCULE-3780339739 [0,1,0,1,0,0|2,0,0]=4 3367 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [0,1,0,1,0,0|2,0,0]=4 3368 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [0,1,0,1,0,0|2,0,0]=4 3369 B8R1.18 CN1CC(=O)CC1=O MCULE-9941627549 [0,1,0,1,0,0|2,0,0]=4 3370 B8R1.18 CN1CC(=O)OC1=O MCULE-7537862268 [0,1,0,1,0,0|1,0,1]=4 3371 B8R1.18 CN1CC(CC1=O)I MCULE-4945824576 [0,1,0,1,0,0|2,0,0]=4 3372 B8R1.18 CN1CC(CC1=O)N MCULE-2463085778 [0,1,0,1,0,0|2,0,0]=4 3373 B8R1.18 CN1CC(CC1=O)N MCULE-2958084133 [0,1,0,1,0,0|2,0,0]=4 3374 B8R1.18 CN1CC(CC1=O)O MCULE-3900359646 [0,1,0,1,0,0|2,0,0]=4 3375 B8R1.18 CN1C[C@@H](CC1=O)N MCULE-5898871508 [0,1,0,1,0,0|2,0,0]=4 3376 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-6983684031 [0,1,0,1,0,0|2,0,0]=4 3377 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-9036883490 [0,1,0,1,0,0|2,0,0]=4 3378 B8R1.18 CN1C[C@H](CC1=O)N MCULE-6260844558 [0,1,0,1,0,0|2,0,0]=4 3379 B8R1.18 CN1C[C@H](CC1=O)N MCULE-9464195407 [0,1,0,1,0,0|2,0,0]=4 3380 B8R1.18 CN1C[C@H](CC1=O)O MCULE-1129246553 [0,1,0,1,0,0|2,0,0]=4 3381 B8R1.18 CN1C[C@H](CC1=O)O MCULE-3762455862 [0,1,0,1,0,0|2,0,0]=4 3382 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [0,1,0,1,0,0|1,0,1]=4 3383 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [0,1,0,1,0,0|1,0,0]=3 3384 B8R1.31 CC(C)C1CCC1=O MCULE-1869737626 [0,1,0,1,0,0|2,0,0]=4 3385 B8R1.40 CCC(=O)CC1CC1 MCULE-7991524982 [0,1,0,1,0,0|2,0,0]=4 3386 B8R1.40 CNC(=O)NC1CC1 MCULE-7333117512 [0,1,0,1,0,0|2,0,0]=4 3387 B8R1.40 COC(=O)C=C1CC1 MCULE-9046312556 [0,1,0,1,0,0|1,0,1]=4 3388 B8R1.40 COC(=O)CC1CC1 MCULE-5556326610 [0,1,0,1,0,0|1,0,0]=3 3389 B8R1.40 COC(=O)CC1CO1 MCULE-1978729257 [0,1,0,1,0,0|0,1,0]=3 3390 B8R1.40 COC(=O)C[C@@H]1CO1 MCULE-5425441463 [0,1,0,1,0,0|0,1,0]=3 3391 B8R1.51 CC1(CCC(=O)C1)C MCULE-9814375082 [0,1,0,1,0,0|2,0,0]=4 3392 B8R1.51 CC1(CNC(=O)C1)C MCULE-1184902754 [0,1,0,1,0,0|2,0,0]=4 3393 B8R1.51 CC1(CNC(=O)C1)O MCULE-3317128471 [0,1,0,1,0,0|2,0,0]=4 3394 B8R1.51 CC1(COC(=O)C1)C MCULE-2810911497 [0,1,0,1,0,0|1,0,0]=3 3395 B8R1.51 CC1(COC(=O)N1)C MCULE-9709457440 [0,1,0,1,0,0|2,0,0]=4 3396 B8R1.51 CC1COS(=O)(=O)C1 MCULE-3208476537 [0,1,0,1,0,0|2,0,0]=4 3397 B8R1.83 CCC(=O)C1CC1C MCULE-4552256059 [0,1,0,1,0,0|2,0,0]=4 3398 B8R1.83 COC(=O)C1CC1Br MCULE-8891645401 [0,1,0,1,0,0|1,0,0]=3 3399 B8R1.83 COC(=O)C1CC1C MCULE-9202068586 [0,1,0,1,0,0|1,0,0]=3 3400 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br MCULE-3965032710 [0,1,0,1,0,0|1,0,0]=3 3401 B8R1.83 COC(=O)[C@H]1C[C@@H]1Br MCULE-9083522272 [0,1,0,1,0,0|1,0,0]=3 3402 B8R1.2 COC1=CCC=CC1 MCULE-7415926731 [0,1,0,1,0,0|2,0,0]=4 3403 B8R1.2 COC1=CCCCC1 MCULE-9079372045 [0,1,0,1,0,0|2,0,0]=4 3404 B8R1.2 COC1=CCOCC1 MCULE-8337045524 [0,1,0,1,0,0|1,1,0]=4 3405 B8R1.2 COC1=NCCCC1 MCULE-3080988027 [0,1,0,1,0,0|2,0,0]=4 3406 B8R1.2 COC1=NCCOC1 MCULE-6346383497 [0,1,0,1,0,0|1,1,0]=4 3407 B8R1.2 CSC1=NCCSC1 MCULE-1243311765 [0,1,0,1,0,0|1,1,0]=4 3408 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [0,1,0,1,0,0|2,0,0]=4 3409 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [0,1,0,1,0,0|1,1,0]=4 3410 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [0,1,0,1,0,0|1,0,0]=3 3411 B8R1.2 O=CC1=COCCO1 MCULE-4502742368 [0,1,0,1,0,0|0,1,1]=4 3412 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [0,1,0,1,0,0|1,0,1]=4 3413 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [0,1,0,1,0,0|1,0,1]=4 3414 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [0,1,0,1,0,0|0,1,1]=4 3415 B8R1.3 C1(CNC(=O)CN1)C MCULE-9891046463 [0,1,0,1,0,0|2,0,0]=4 3416 B8R1.3 CC1=CCC(=O)CC1 MCULE-5396065385 [0,1,0,1,0,0|2,0,0]=4 3417 B8R1.3 CC1CCC(=O)CC1 MCULE-5534475096 [0,1,0,1,0,0|2,0,0]=4 3418 B8R1.3 CC1CCC(=O)CC1 MCULE-9038467737 [0,1,0,1,0,0|2,0,0]=4 3419 B8R1.3 CC1CCC(=O)CN1 MCULE-1285022466 [0,1,0,1,0,0|2,0,0]=4 3420 B8R1.3 CC1CCC(=O)CN1 MCULE-9314433387 [0,1,0,1,0,0|2,0,0]=4 3421 B8R1.3 CC1CCC(=O)CO1 MCULE-8334906567 [0,1,0,1,0,0|1,1,0]=4 3422 B8R1.3 CC1CCC(=O)CS1 MCULE-9188619559 [0,1,0,1,0,0|1,0,0]=3 3423 B8R1.3 CC1CCC(=O)NC1 MCULE-1307751847 [0,1,0,1,0,0|2,0,0]=4 3424 B8R1.3 CC1CNC(=O)CN1 MCULE-2050820306 [0,1,0,1,0,0|2,0,0]=4 3425 B8R1.3 CC1CNC(=O)CN1 MCULE-9509469557 [0,1,0,1,0,0|2,0,0]=4 3426 B8R1.3 CC1CNC(=O)CO1 MCULE-6817757578 [0,1,0,1,0,0|1,1,0]=4 3427 B8R1.3 CC1COC(=O)OC1 MCULE-6795228051 [0,1,0,1,0,0|1,0,0]=3 3428 B8R1.3 CN1CCC(=O)CC1 MCULE-3370577555 [0,1,0,1,0,0|2,0,0]=4 3429 B8R1.3 CN1CCC(=O)CC1 MCULE-5364011649 [0,1,0,1,0,0|2,0,0]=4 3430 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-4693797730 [0,1,0,1,0,0|2,0,0]=4 3431 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-5991774380 [0,1,0,1,0,0|2,0,0]=4 3432 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-6484213897 [0,1,0,1,0,0|2,0,0]=4 3433 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-7346191190 [0,1,0,1,0,0|2,0,0]=4 3434 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1088991552 [0,1,0,1,0,0|2,0,0]=4 3435 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1952714815 [0,1,0,1,0,0|2,0,0]=4 3436 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-3350871833 [0,1,0,1,0,0|2,0,0]=4 3437 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-9637742350 [0,1,0,1,0,0|2,0,0]=4 3438 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7192421297 [0,1,0,1,0,0|1,1,0]=4 3439 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7394512903 [0,1,0,1,0,0|1,1,0]=4 3440 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-6334939841 [0,1,0,1,0,0|2,0,0]=4 3441 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-8476307649 [0,1,0,1,0,0|2,0,0]=4 3442 B8R1.3 C[C@H]1CCC(=O)NC1 MCULE-5712112445 [0,1,0,1,0,0|2,0,0]=4 3443 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-3373819559 [0,1,0,1,0,0|2,0,0]=4 3444 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-4486681671 [0,1,0,1,0,0|2,0,0]=4 3445 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-7180229103 [0,1,0,1,0,0|2,0,0]=4 3446 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-9466864223 [0,1,0,1,0,0|2,0,0]=4 3447 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-6169535590 [0,1,0,1,0,0|1,1,0]=4 3448 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-8876635175 [0,1,0,1,0,0|1,1,0]=4 3449 B8R1.3 NC1CCC(=O)CC1 MCULE-5825363145 [0,1,0,1,0,0|2,0,0]=4 3450 B8R1.3 NC1CCC(=O)CC1 MCULE-6212878324 [0,1,0,1,0,0|2,0,0]=4 3451 B8R1.3 NC1CCC(=O)NC1 MCULE-2677675224 [0,1,0,1,0,0|2,0,0]=4 3452 B8R1.3 NC1CCC(=O)NC1 MCULE-8711968877 [0,1,0,1,0,0|2,0,0]=4 3453 B8R1.3 NC1CCC(=O)NC1 MCULE-8915391016 [0,1,0,1,0,0|2,0,0]=4 3454 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-5372893548 [0,1,0,1,0,0|2,0,0]=4 3455 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6411408704 [0,1,0,1,0,0|2,0,0]=4 3456 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6771263407 [0,1,0,1,0,0|2,0,0]=4 3457 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-9035818807 [0,1,0,1,0,0|2,0,0]=4 3458 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-1921494480 [0,1,0,1,0,0|2,0,0]=4 3459 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-4843708987 [0,1,0,1,0,0|2,0,0]=4 3460 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-6599794889 [0,1,0,1,0,0|2,0,0]=4 3461 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-7112568050 [0,1,0,1,0,0|2,0,0]=4 3462 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9053885307 [0,1,0,1,0,0|2,0,0]=4 3463 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9780118077 [0,1,0,1,0,0|2,0,0]=4 3464 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [0,1,0,1,0,0|1,0,1]=4 3465 B8R1.3 O=C1CCC(CC1)Br MCULE-1177789896 [0,1,0,1,0,0|2,0,0]=4 3466 B8R1.3 O=C1CCC(CC1)Cl MCULE-3647406761 [0,1,0,1,0,0|2,0,0]=4 3467 B8R1.3 O=C1CCC(CC1)F MCULE-5757540710 [0,1,0,1,0,0|2,0,0]=4 3468 B8R1.3 O=C1CCC(CC1)O MCULE-7247867750 [0,1,0,1,0,0|2,0,0]=4 3469 B8R1.3 O=C1CCC(CN1)F MCULE-1848493447 [0,1,0,1,0,0|2,0,0]=4 3470 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [0,1,0,1,0,0|2,0,0]=4 3471 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [0,1,0,1,0,0|1,0,0]=3 3472 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [0,1,0,1,0,0|2,0,0]=4 3473 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [0,1,0,1,0,0|2,0,0]=4 3474 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [0,1,0,1,0,0|2,0,0]=4 3475 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [0,1,0,1,0,0|2,0,0]=4 3476 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [0,1,0,1,0,0|1,0,1]=4 3477 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [0,1,0,1,0,0|0,1,1]=4 3478 B8R1.5 CC1=CCCCC1=O MCULE-6245248136 [0,1,0,1,0,0|2,0,0]=4 3479 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,1,0,1,0,0|2,0,0]=4 3480 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [0,1,0,1,0,0|2,0,0]=4 3481 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [0,1,0,1,0,0|1,0,0]=3 3482 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [0,1,0,1,0,0|2,0,0]=4 3483 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [0,1,0,1,0,0|2,0,0]=4 3484 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [0,1,0,1,0,0|1,1,0]=4 3485 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [0,1,0,1,0,0|2,0,0]=4 3486 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [0,1,0,1,0,0|2,0,0]=4 3487 B8R1.5 CC1COCCC1=O MCULE-2694187526 [0,1,0,1,0,0|1,1,0]=4 3488 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,1,0,1,0,0|1,0,0]=3 3489 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [0,1,0,1,0,0|2,0,0]=4 3490 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [0,1,0,1,0,0|2,0,0]=4 3491 B8R1.5 CC1NCCNC1=O MCULE-3078767867 [0,1,0,1,0,0|2,0,0]=4 3492 B8R1.5 CC1NCCNC1=O MCULE-9884862705 [0,1,0,1,0,0|2,0,0]=4 3493 B8R1.5 CC1OCCNC1=O MCULE-8812176499 [0,1,0,1,0,0|1,1,0]=4 3494 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [0,1,0,1,0,0|1,0,0]=3 3495 B8R1.5 CC1SCCNC1=O MCULE-1825894745 [0,1,0,1,0,0|1,0,0]=3 3496 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [0,1,0,1,0,0|2,0,0]=4 3497 B8R1.5 CN1CCCNC1=O MCULE-3141639397 [0,1,0,1,0,0|2,0,0]=4 3498 B8R1.5 CN1CCNCC1=O MCULE-4783963074 [0,1,0,1,0,0|2,0,0]=4 3499 B8R1.5 CN1CCNCC1=O MCULE-7251084542 [0,1,0,1,0,0|2,0,0]=4 3500 B8R1.5 CN1CCNCC1=O MCULE-9201460493 [0,1,0,1,0,0|2,0,0]=4 3501 B8R1.5 CN1CCNCC1=O MCULE-9789420240 [0,1,0,1,0,0|2,0,0]=4 3502 B8R1.5 CN1CCOCC1=O MCULE-8864378597 [0,1,0,1,0,0|1,1,0]=4 3503 B8R1.5 C[C@@H]1NCCNC1=O MCULE-1719923601 [0,1,0,1,0,0|2,0,0]=4 3504 B8R1.5 C[C@@H]1NCCNC1=O MCULE-3211216058 [0,1,0,1,0,0|2,0,0]=4 3505 B8R1.5 C[C@@H]1NCCNC1=O MCULE-4268624973 [0,1,0,1,0,0|2,0,0]=4 3506 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [0,1,0,1,0,0|2,0,0]=4 3507 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [0,1,0,1,0,0|2,0,0]=4 3508 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [0,1,0,1,0,0|1,1,0]=4 3509 B8R1.5 C[C@H]1NCCNC1=O MCULE-1350777729 [0,1,0,1,0,0|2,0,0]=4 3510 B8R1.5 C[C@H]1NCCNC1=O MCULE-3433713206 [0,1,0,1,0,0|2,0,0]=4 3511 B8R1.5 C[C@H]1NCCNC1=O MCULE-6014092524 [0,1,0,1,0,0|2,0,0]=4 3512 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,1,0,1,0,0|2,0,0]=4 3513 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,1,0,1,0,0|2,0,0]=4 3514 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [0,1,0,1,0,0|2,0,0]=4 3515 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [0,1,0,1,0,0|2,0,0]=4 3516 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [0,1,0,1,0,0|2,0,0]=4 3517 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [0,1,0,1,0,0|2,0,0]=4 3518 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [0,1,0,1,0,0|2,0,0]=4 3519 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [0,1,0,1,0,0|2,0,0]=4 3520 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [0,1,0,1,0,0|2,0,0]=4 3521 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [0,1,0,1,0,0|2,0,0]=4 3522 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [0,1,0,1,0,0|2,0,0]=4 3523 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [0,1,0,1,0,0|2,0,0]=4 3524 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [0,1,0,1,0,0|2,0,0]=4 3525 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [0,1,0,1,0,0|2,0,0]=4 3526 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [0,1,0,1,0,0|2,0,0]=4 3527 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [0,1,0,1,0,0|2,0,0]=4 3528 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [0,1,0,1,0,0|2,0,0]=4 3529 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [0,1,0,1,0,0|2,0,0]=4 3530 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,1,0,1,0,0|2,0,0]=4 3531 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,1,0,1,0,0|2,0,0]=4 3532 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,1,0,1,0,0|2,0,0]=4 3533 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,1,0,1,0,0|2,0,0]=4 3534 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [0,1,0,1,0,0|2,0,0]=4 3535 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,1,0,1,0,0|2,0,0]=4 3536 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,1,0,1,0,0|2,0,0]=4 3537 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,1,0,1,0,0|2,0,0]=4 3538 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,1,0,1,0,0|2,0,0]=4 3539 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,1,0,1,0,0|2,0,0]=4 3540 B8R1.5 O=C1NCCOC1=O MCULE-5092732656 [0,1,0,1,0,0|1,0,1]=4 3541 B8R1.5 O=C1OCCC=C1Br MCULE-6619697801 [0,1,0,1,0,0|1,0,1]=4 3542 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [0,1,0,1,0,0|1,0,0]=3 3543 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,1,0,1,0,0|1,0,0]=3 3544 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [0,1,0,1,0,0|2,0,0]=4 3545 B8R1.13 O=C1CCC1CCCl MCULE-1577834742 [0,1,0,1,0,0|2,0,0]=4 3546 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [0,1,0,1,0,0|2,0,0]=4 3547 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [0,1,0,1,0,0|2,0,0]=4 3548 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [0,1,0,1,0,0|1,1,0]=4 3549 B8R1.22 C=C1OCCCCO1 MCULE-8283334358 [0,1,0,1,0,0|2,0,0]=4 3550 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [0,1,0,1,0,0|2,0,0]=4 3551 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,1,0,1,0,0|2,0,0]=4 3552 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [0,1,0,1,0,0|2,0,0]=4 3553 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [0,1,0,1,0,0|1,0,0]=3 3554 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,1,0,1,0,0|2,0,0]=4 3555 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,1,0,1,0,0|2,0,0]=4 3556 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [0,1,0,1,0,0|2,0,0]=4 3557 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [0,1,0,1,0,0|2,0,0]=4 3558 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [0,1,0,1,0,0|1,1,0]=4 3559 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [0,1,0,1,0,0|1,0,0]=3 3560 B8R1.22 O=C1CCNCCN1 MCULE-1678306131 [0,1,0,1,0,0|2,0,0]=4 3561 B8R1.22 O=C1CCNCCN1 MCULE-1867860146 [0,1,0,1,0,0|2,0,0]=4 3562 B8R1.22 O=C1CCOCCN1 MCULE-6881734685 [0,1,0,1,0,0|1,1,0]=4 3563 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [0,1,0,1,0,0|0,1,0]=3 3564 B8R1.22 O=C1CCSCCN1 MCULE-9445131358 [0,1,0,1,0,0|1,0,0]=3 3565 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [0,1,0,1,0,0|2,0,0]=4 3566 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [0,1,0,1,0,0|2,0,0]=4 3567 B8R1.22 O=C1CNCCNC1 MCULE-2450825992 [0,1,0,1,0,0|2,0,0]=4 3568 B8R1.22 O=C1CNCCNC1 MCULE-7379420394 [0,1,0,1,0,0|2,0,0]=4 3569 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,1,0,1,0,0|1,0,0]=3 3570 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,1,0,1,0,0|1,0,0]=3 3571 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,1,0,1,0,0|1,1,0]=4 3572 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,1,0,1,0,0|0,1,0]=3 3573 B8R1.22 O=C1CSCCSC1 MCULE-5039848738 [0,1,0,1,0,0|0,1,0]=3 3574 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [0,1,0,1,0,0|1,0,0]=3 3575 B8R1.22 O=S1OCCCCO1 MCULE-6898726705 [0,1,0,1,0,0|2,0,0]=4 3576 B8R1.38 C1(CCN1)C(=O)OC MCULE-4001628620 [0,1,0,1,0,0|1,0,0]=3 3577 B8R1.38 C1(CCN1)C(=O)OC MCULE-6304194058 [0,1,0,1,0,0|1,0,0]=3 3578 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,1,0,1,0,0|2,0,0]=4 3579 B8R1.38 CCC(=O)C1COC1 MCULE-2036532813 [0,1,0,1,0,0|1,1,0]=4 3580 B8R1.38 CNC(=O)C1CCC1 MCULE-7934051142 [0,1,0,1,0,0|2,0,0]=4 3581 B8R1.38 CNC(=O)C1CNC1 MCULE-1757312789 [0,1,0,1,0,0|2,0,0]=4 3582 B8R1.38 CNC(=O)C1CNC1 MCULE-5774189315 [0,1,0,1,0,0|2,0,0]=4 3583 B8R1.38 CNC(=O)C1CNC1 MCULE-8342593933 [0,1,0,1,0,0|2,0,0]=4 3584 B8R1.38 COC(=O)C1=CCC1 MCULE-5016158090 [0,1,0,1,0,0|1,0,1]=4 3585 B8R1.38 COC(=O)C1CCC1 MCULE-2900002276 [0,1,0,1,0,0|1,0,0]=3 3586 B8R1.38 COC(=O)C1CCN1 MCULE-2766647683 [0,1,0,1,0,0|1,0,0]=3 3587 B8R1.38 COC(=O)C1CCN1 MCULE-6440918459 [0,1,0,1,0,0|1,0,0]=3 3588 B8R1.38 COC(=O)C1CCN1 MCULE-6964468849 [0,1,0,1,0,0|1,0,0]=3 3589 B8R1.38 COC(=O)C1CCO1 MCULE-7860079290 [0,1,0,1,0,0|0,1,0]=3 3590 B8R1.38 COC(=O)C1CNC1 MCULE-5731952071 [0,1,0,1,0,0|1,0,0]=3 3591 B8R1.38 COC(=O)C1CNC1 MCULE-9436948908 [0,1,0,1,0,0|1,0,0]=3 3592 B8R1.38 COC(=O)C1COC1 MCULE-8897565340 [0,1,0,1,0,0|0,1,0]=3 3593 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-4539844768 [0,1,0,1,0,0|1,0,0]=3 3594 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-5257592845 [0,1,0,1,0,0|1,0,0]=3 3595 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7483834256 [0,1,0,1,0,0|1,0,0]=3 3596 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7502882004 [0,1,0,1,0,0|1,0,0]=3 3597 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-1944761309 [0,1,0,1,0,0|1,0,0]=3 3598 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-2075005250 [0,1,0,1,0,0|1,0,0]=3 3599 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-5626630564 [0,1,0,1,0,0|1,0,0]=3 3600 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-8309542560 [0,1,0,1,0,0|1,0,0]=3 3601 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [0,1,0,1,0,0|2,0,0]=4 3602 B8R1.50 CC1=C(C(=O)NC1)C MCULE-4444366984 [0,1,0,1,0,0|2,0,0]=4 3603 B8R1.50 CC1=C(C(=O)OC1)O MCULE-7870847121 [0,1,0,1,0,0|1,0,1]=4 3604 B8R1.50 CC1=NOC(=O)C1C MCULE-6668573558 [0,1,0,1,0,0|2,0,0]=4 3605 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [0,1,0,1,0,0|2,0,0]=4 3606 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,1,0,1,0,0|2,0,0]=4 3607 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [0,1,0,1,0,0|2,0,0]=4 3608 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,1,0,1,0,0|2,0,0]=4 3609 B8R1.50 CC1CCN(C1=O)C MCULE-1499213360 [0,1,0,1,0,0|2,0,0]=4 3610 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [0,1,0,1,0,0|2,0,0]=4 3611 B8R1.50 CC1NCN(C1=O)C MCULE-2390134887 [0,1,0,1,0,0|2,0,0]=4 3612 B8R1.50 CC1NCN(C1=O)C MCULE-7463423136 [0,1,0,1,0,0|2,0,0]=4 3613 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [0,1,0,1,0,0|1,1,0]=4 3614 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [0,1,0,1,0,0|2,0,0]=4 3615 B8R1.50 CN1C(=O)CSC1=O MCULE-8837313577 [0,1,0,1,0,0|1,0,1]=4 3616 B8R1.50 CN1C(=O)CSC1=S MCULE-8742608574 [0,1,0,1,0,0|1,0,1]=4 3617 B8R1.50 CN1CCC(C1=O)Br MCULE-9857530514 [0,1,0,1,0,0|2,0,0]=4 3618 B8R1.50 CN1CCC(C1=O)Cl MCULE-5732339719 [0,1,0,1,0,0|2,0,0]=4 3619 B8R1.50 CN1CCC(C1=O)N MCULE-2896853309 [0,1,0,1,0,0|2,0,0]=4 3620 B8R1.50 CN1CCC(C1=O)N MCULE-5951659989 [0,1,0,1,0,0|2,0,0]=4 3621 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [0,1,0,1,0,0|2,0,0]=4 3622 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-3820062607 [0,1,0,1,0,0|2,0,0]=4 3623 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-7270649984 [0,1,0,1,0,0|2,0,0]=4 3624 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-8015311112 [0,1,0,1,0,0|2,0,0]=4 3625 B8R1.50 CN1CC[C@H](C1=O)N MCULE-1278006515 [0,1,0,1,0,0|2,0,0]=4 3626 B8R1.50 CN1CC[C@H](C1=O)N MCULE-3751335664 [0,1,0,1,0,0|2,0,0]=4 3627 B8R1.50 CN1CC[C@H](C1=O)N MCULE-4883949932 [0,1,0,1,0,0|2,0,0]=4 3628 B8R1.50 CN1CC[C@H](C1=O)N MCULE-7143065464 [0,1,0,1,0,0|2,0,0]=4 3629 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,1,0,1,0,0|2,0,0]=4 3630 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,1,0,1,0,0|2,0,0]=4 3631 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,1,0,1,0,0|2,0,0]=4 3632 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-5447777048 [0,1,0,1,0,0|2,0,0]=4 3633 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-8691985034 [0,1,0,1,0,0|2,0,0]=4 3634 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,1,0,1,0,0|2,0,0]=4 3635 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,1,0,1,0,0|2,0,0]=4 3636 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,1,0,1,0,0|2,0,0]=4 3637 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,1,0,1,0,0|2,0,0]=4 3638 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,1,0,1,0,0|2,0,0]=4 3639 B8R1.58 CCC1(CCC1=O)C MCULE-1365656204 [0,1,0,1,0,0|2,0,0]=4 3640 B8R1.19 CC1(CCCC1=O)C MCULE-2010694408 [0,1,0,1,0,0|2,0,0]=4 3641 B8R1.19 CC1(CCCC1=O)F MCULE-5382994089 [0,1,0,1,0,0|2,0,0]=4 3642 B8R1.19 CC1(COCC1=O)C MCULE-8148059071 [0,1,0,1,0,0|1,1,0]=4 3643 B8R1.37 CCCC(=O)C1CC1 MCULE-5533671390 [0,1,0,1,0,0|2,0,0]=4 3644 B8R1.37 CCOC(=N)C1CC1 MCULE-2588423044 [0,1,0,1,0,0|2,0,0]=4 3645 B8R1.37 CCOC(=N)C1CC1 MCULE-3591830795 [0,1,0,1,0,0|2,0,0]=4 3646 B8R1.37 CCOC(=O)C1CC1 MCULE-1233809766 [0,1,0,1,0,0|1,0,0]=3 3647 B8R1.37 CCOC(=O)C1CO1 MCULE-6286980506 [0,1,0,1,0,0|0,1,0]=3 3648 B8R1.37 CCOC(=O)[C@@H]1CO1 MCULE-2938641654 [0,1,0,1,0,0|0,1,0]=3 3649 B8R1.37 CCOC(=O)[C@@H]1CO1 MCULE-4221865731 [0,1,0,1,0,0|0,1,0]=3 3650 B8R1.37 CCOC(=O)[C@H]1CO1 MCULE-6602474167 [0,1,0,1,0,0|0,1,0]=3 3651 B8R1.37 COCC(=O)C1CC1 MCULE-9169780113 [0,1,0,1,0,0|1,0,0]=3 3652 B8R1.37 CONC(=O)C1CC1 MCULE-1146603952 [0,1,0,1,0,0|1,0,0]=3 3653 B8R1.37 O=C(OCCl)C1CC1 MCULE-6572714787 [0,1,0,1,0,0|1,0,0]=3 3654 B8R1.54 CC(=O)C(=O)C1CC1 MCULE-6206613019 [0,1,0,1,0,0|2,0,0]=4 3655 B8R1.54 CC(Br)C(=O)C1CC1 MCULE-4786532022 [0,1,0,1,0,0|2,0,0]=4 3656 B8R1.54 CC(C)C(=O)C1CC1 MCULE-7614369244 [0,1,0,1,0,0|2,0,0]=4 3657 B8R1.54 CN(C)C(=O)C1CC1 MCULE-2661320301 [0,1,0,1,0,0|2,0,0]=4 3658 B8R1.54 C[C@H](Br)C(=O)C1CC1 MCULE-9338949407 [0,1,0,1,0,0|2,0,0]=4 3659 B8R1.8 CCCC1=NCCO1 MCULE-4941877816 [0,1,0,1,0,0|2,0,0]=4 3660 B8R1.8 CCOC1=NCCC1 MCULE-7392104128 [0,1,0,1,0,0|2,0,0]=4 3661 B8R1.8 CNCC1=CCSC1 MCULE-9764664300 [0,1,0,1,0,0|2,0,0]=4 3662 B8R1.8 CSCC1=CC=CO1 MCULE-5733837840 [0,1,0,1,0,0|1,0,1]=4 3663 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [0,1,0,1,0,0|2,0,0]=4 3664 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [0,1,0,1,0,0|2,0,0]=4 3665 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [0,1,0,1,0,0|1,0,0]=3 3666 B8R1.11 CCC1COCC1=O MCULE-5486171882 [0,1,0,1,0,0|1,0,0]=3 3667 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [0,1,0,1,0,0|2,0,0]=4 3668 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [0,1,0,1,0,0|2,0,0]=4 3669 B8R1.11 CCN1CNCC1=O MCULE-2327338525 [0,1,0,1,0,0|2,0,0]=4 3670 B8R1.11 CNC1CCNC1=O MCULE-1302732570 [0,1,0,1,0,0|2,0,0]=4 3671 B8R1.11 CNC1CCNC1=O MCULE-7065523709 [0,1,0,1,0,0|2,0,0]=4 3672 B8R1.11 COC1=CCCC1=O MCULE-2849263860 [0,1,0,1,0,0|1,0,1]=4 3673 B8R1.11 COC1CCCC1=O MCULE-2741778082 [0,1,0,1,0,0|1,0,0]=3 3674 B8R1.11 COC1CCOC1=O MCULE-6321591157 [0,1,0,1,0,0|0,1,0]=3 3675 B8R1.11 COC1COCC1=O MCULE-2097991610 [0,1,0,1,0,0|0,1,0]=3 3676 B8R1.11 N#CC1CCOC1=O MCULE-4716981850 [0,1,0,1,0,0|2,0,0]=4 3677 B8R1.11 N#CC1COCC1=O MCULE-8235489299 [0,1,0,1,0,0|2,0,0]=4 3678 B8R1.11 N#CC1CSCC1=O MCULE-5156436630 [0,1,0,1,0,0|1,0,1]=4 3679 B8R1.11 N#C[C@H]1COCC1=O MCULE-3727267765 [0,1,0,1,0,0|2,0,0]=4 3680 B8R1.11 N#C[C@H]1CSCC1=O MCULE-1823296344 [0,1,0,1,0,0|1,0,1]=4 3681 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [0,1,0,1,0,0|2,0,0]=4 3682 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [0,1,0,1,0,0|2,0,0]=4 3683 B8R1.11 NCC1CCOC1=O MCULE-5843107965 [0,1,0,1,0,0|2,0,0]=4 3684 B8R1.11 NCC1CCOC1=O MCULE-6077637171 [0,1,0,1,0,0|2,0,0]=4 3685 B8R1.11 NOC1CCOC1=O MCULE-1912651031 [0,1,0,1,0,0|1,1,0]=4 3686 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [0,1,0,1,0,0|2,0,0]=4 3687 B8R1.11 O=C1CCCN1CBr MCULE-1337183945 [0,1,0,1,0,0|2,0,0]=4 3688 B8R1.11 O=C1CCCN1CCl MCULE-6204630639 [0,1,0,1,0,0|2,0,0]=4 3689 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [0,1,0,1,0,0|2,0,0]=4 3690 B8R1.11 O=C1CNCN1CO MCULE-1880077159 [0,1,0,1,0,0|2,0,0]=4 3691 B8R1.11 O=C1CNCN1CO MCULE-4265247225 [0,1,0,1,0,0|2,0,0]=4 3692 B8R1.11 O=CC1CCOC1=O MCULE-6358043470 [0,1,0,1,0,0|2,0,0]=4 3693 B8R1.39 CNC(=O)C1(CC1)N MCULE-5670276563 [0,1,0,1,0,0|2,0,0]=4 3694 B8R1.39 COC(=O)C1(CC1)Br MCULE-3569653934 [0,1,0,1,0,0|1,0,0]=3 3695 B8R1.39 COC(=O)C1(CC1)C MCULE-1688202939 [0,1,0,1,0,0|1,0,0]=3 3696 B8R1.39 COC(=O)C1(CC1)F MCULE-5595108152 [0,1,0,1,0,0|1,0,0]=3 3697 B8R1.39 COC(=O)C1(CC1)N MCULE-7742849761 [0,1,0,1,0,0|1,0,0]=3 3698 B8R1.39 COC(=O)C1(CC1)N MCULE-8414845491 [0,1,0,1,0,0|1,0,0]=3 3699 B8R1.39 COC(=O)C1(CC1)O MCULE-3205655719 [0,1,0,1,0,0|1,0,0]=3 3700 B8R1.39 COC(=O)C1(CO1)C MCULE-9345493771 [0,1,0,1,0,0|0,1,0]=3 3701 B8R1.72 O=S1(=O)CCCCO1 MCULE-8722166220 [0,1,0,1,0,0|2,0,0]=4 3702 B8R1.33 COC(C=O)C1CC1 MCULE-3422346780 [0,1,0,1,0,0|1,0,1]=4 3703 B8R1.60 COC1(CSC1)OC MCULE-3565613218 [0,1,0,1,0,0|0,0,2]=4 3704 B8R2.4 O=C1CC2CC1C2 MCULE-5372379094 [0,0,0,2,0,0|2,0,0]=4 3705 B8R2.18 O=C1CC2CC2C1 MCULE-4411193370 [0,0,0,2,0,0|2,0,0]=4 3706 B8R2.18 O=C1CC2CC2N1 MCULE-6301280583 [0,0,0,2,0,0|2,0,0]=4 3707 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 MCULE-3069760916 [0,0,0,2,0,0|2,0,0]=4 3708 B8R2.38 O=C1CCC2C1C2 MCULE-4714285285 [0,0,0,2,0,0|2,0,0]=4 3709 B8R2.38 O=C1CCC2C1O2 MCULE-5532735099 [0,0,0,2,0,0|1,1,0]=4 3710 B8R2.38 O=C1CC[C@@H]2[C@H]1C2 MCULE-7728867768 [0,0,0,2,0,0|2,0,0]=4 3711 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-1007541778 [0,0,0,2,0,0|2,0,0]=4 3712 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-8077752466 [0,0,0,2,0,0|2,0,0]=4 3713 B8R2.38 O=C1NCC2C1C2 MCULE-5593114305 [0,0,0,2,0,0|2,0,0]=4 3714 B8R2.38 O=C1NC[C@H]2[C@@H]1C2 MCULE-6438081695 [0,0,0,2,0,0|2,0,0]=4 3715 B8R2.19 O=C1CCC12CC2 MCULE-6343718897 [0,0,0,2,0,0|2,0,0]=4